Substances (GSRS)

1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]-9,10-anthracenedione

Also: 1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]anthraquinone, 9,10-Anthracenedione, 1-[[3-(dimethylamino)propyl]amino]-4-[(4-m…

chemicalUNII UWK39H3RQN

Open FDA's page for this record

Substance class

chemical

Definition type

PRIMARY

Definition level

COMPLETE

Uuid

74311090-cbc2-4ea4-a215-1b17ac935bb7

Version

UNII

UWK39H3RQN

Codes

Uuid
43773a08-c8f4-458f-8226-1f72f6d5a570
Code
25743-94-6
Type
PRIMARY
Url
https://commonchemistry.cas.org/detail?cas_rn=25743-94-6
Code system
CAS
References
a0e99472-931c-4f6d-b25a-3d592b31d853, 8df218d1-fe83-4059-937b-c06850973f71
Uuid
d327c984-958b-42ff-bb75-08d74001f951
Code
247-226-8
Type
PRIMARY
Url
https://echa.europa.eu/substance-information/-/substanceinfo/100.042.919
Code system
ECHA (EC/EINECS)
References
a0e99472-931c-4f6d-b25a-3d592b31d853
Uuid
d8d8248b-2d78-4460-ae5f-aab2e62e3ed5
Code
117621
Type
PRIMARY
Url
https://pubchem.ncbi.nlm.nih.gov/compound/117621
Code system
PUBCHEM
References
a0e99472-931c-4f6d-b25a-3d592b31d853
Uuid
46cee825-a2d5-0f0e-386f-cd80cd6c2284
Code
DTXSID0067133
Type
PRIMARY
Url
https://comptox.epa.gov/dashboard/chemical/details/DTXSID0067133
Code system
EPA CompTox
References
7eb5dc8b-5e46-0dc1-1b28-39c4eb9d3a30
Uuid
bc017132-ea73-4545-8c07-8575f694a028
Code
UWK39H3RQN
Type
PRIMARY
Code system
FDA UNII

Names

Uuid
8311243d-0078-494d-8acb-d1fc3a102f40
Name
1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]-9,10-anthracenedione
StdName
1-((3-(DIMETHYLAMINO)PROPYL)AMINO)-4-((4-METHYLPHENYL)AMINO)-9,10-ANTHRACENEDIONE
Type
sys
Preferred
false
Display name
false
Languages
en
References
8df218d1-fe83-4059-937b-c06850973f71
Uuid
b3d33748-9d1c-4dce-b65b-502956b27da1
Name
1-[[3-(Dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]anthraquinone
StdName
1-((3-(DIMETHYLAMINO)PROPYL)AMINO)-4-((4-METHYLPHENYL)AMINO)ANTHRAQUINONE
Type
sys
Preferred
false
Display name
true
Languages
en
References
8df218d1-fe83-4059-937b-c06850973f71
Uuid
d3cfd69b-816b-4670-970e-5d9d2e39c313
Name
9,10-Anthracenedione, 1-[[3-(dimethylamino)propyl]amino]-4-[(4-methylphenyl)amino]-
StdName
9,10-ANTHRACENEDIONE, 1-((3-(DIMETHYLAMINO)PROPYL)AMINO)-4-((4-METHYLPHENYL)AMINO)-
Type
sys
Preferred
false
Display name
false
Languages
en
References
fbfaf5dc-6b89-478e-9a3c-3dd0b6269275, 6d6d09d6-c329-4444-a5fa-b29e131145bd

References

Uuid
6d6d09d6-c329-4444-a5fa-b29e131145bd
Citation
CHEMID
Doc type
SRS
Public domain
true
Tags
NOMEN
Uuid
fbfaf5dc-6b89-478e-9a3c-3dd0b6269275
Citation
EPA
Doc type
EPA
Public domain
true
Tags
NOMEN
Uuid
a0e99472-931c-4f6d-b25a-3d592b31d853
Citation
SRS CODE IMPORT
Doc type
SRS
Public domain
true
Document date
1493393927000
Tags
NOMEN
Uuid
7eb5dc8b-5e46-0dc1-1b28-39c4eb9d3a30
Citation
WEBSITE
Url
https://comptox.epa.gov/dashboard/dsstoxdb/results?utf8=%E2%9C%93&search=25743-94-6
Doc type
WEBSITE
Public domain
true
Tags
NOMEN, PUBLIC_DOMAIN_RELEASE
Uuid
8df218d1-fe83-4059-937b-c06850973f71
Citation
STN
Doc type
STN (SCIFINDER)
Public domain
true

Moieties

Uuid
14f0e23c-d979-44e9-b8fa-b0da0de84bf0
ID
14f0e23c-d979-44e9-b8fa-b0da0de84bf0
Smiles
Cc1ccc(cc1)Nc2ccc(c3c2C(=O)c4ccccc4C3=O)NCCCN(C)C
Formula
C26H27N3O2
Atropisomerism
No
Charge
0
Count
1
Stereochemistry
ACHIRAL
Defined stereo
0
Ez centers
0
Molecular weight
413.5125
Optical activity
NONE
Stereo centers
0
Molfile
Marvin 01132101172D 31 34 0 0 0 0 999 V2000 0.2847 -7.7607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7011 -7.0451 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2914 -6.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5218 -7.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9382 -6.3333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7589 -6.3370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1752 -5.6215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0002 -5.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4096 -6.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2375 -6.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6487 -5.6324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4737 -5.6363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8829 -6.3526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7107 -6.3573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1162 -7.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7011 -7.7838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1120 -8.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8804 -7.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4677 -7.0656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2429 -4.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6592 -4.2039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4843 -4.2075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2478 -3.4855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6636 -2.7742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2592 -2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4314 -2.0539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0156 -2.7653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4271 -3.4836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0107 -4.1958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1858 -4.1902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4151 -4.9100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 2 3 1 0 0 0 0 4 2 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 8 9 1 0 0 0 0 31 8 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 19 13 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 22 21 2 0 0 0 0 21 23 1 0 0 0 0 24 23 1 0 0 0 0 23 28 2 0 0 0 0 25 24 2 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M END
Count amount
Type
MOL RATIO
Average
1
Units
MOL RATIO
Uuid
5d178c3a-1dd4-4870-98c4-18d2c6343bd6

Structure

ID: b7878277-510c-4893-b920-f97b829db6e3
Smiles: Cc1ccc(cc1)Nc2ccc(c3c2C(=O)c4ccccc4C3=O)NCCCN(C)C
Formula: C26H27N3O2
Atropisomerism: No
Charge: 0
Count: 1
Stereochemistry: ACHIRAL
Defined stereo: 0
Ez centers: 0
Molecular weight: 413.5125
Optical activity: NONE
Stereo centers: 0
Molfile: JSDraw212082318212D 31 34 0 0 0 0 0 V2000 29.4659 -1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1155 -2.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7652 -1.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4146 -2.3409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4143 -3.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7647 -4.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1153 -3.8996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0641 -4.6805 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 24.0641 -6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4153 -7.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4153 -8.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0641 -9.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7128 -8.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7128 -7.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3616 -6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3616 -4.6805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0103 -7.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6591 -6.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3078 -7.0192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3078 -8.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6591 -9.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0103 -8.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3616 -9.3579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3616 -10.9170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.0641 -10.9170 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 25.4143 -11.6966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4143 -13.2557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7646 -14.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7646 -15.5944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 28.1148 -16.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4143 -16.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 2 7 1 0 0 0 0 5 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 9 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 17 22 1 0 0 0 0 22 23 1 0 0 0 0 13 23 1 0 0 0 0 23 24 2 0 0 0 0 12 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 M END
References: 6d6d09d6-c329-4444-a5fa-b29e131145bd

Data from openFDA, FDA's public API. FDA says not to rely on it to make decisions about medical care and to treat every result as unvalidated; confirm against FDA's own record and the product labeling. Not medical or legal advice.