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Details

Stereochemistry MIXED
Molecular Formula C28H32Cl2N6
Molecular Weight 523.5
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments Assumed mixed

SHOW SMILES / InChI
Structure of WR-3863

SMILES

CC(CN1CCN(CC(C)NC2=C3C=CC(Cl)=CC3=NC=C2)CC1)NC4=CC=NC5=C4C=CC(Cl)=C5

InChI

InChIKey=FIERVDLXKNFTPK-UHFFFAOYSA-N
InChI=1S/C28H32Cl2N6/c1-19(33-25-7-9-31-27-15-21(29)3-5-23(25)27)17-35-11-13-36(14-12-35)18-20(2)34-26-8-10-32-28-16-22(30)4-6-24(26)28/h3-10,15-16,19-20H,11-14,17-18H2,1-2H3,(H,31,33)(H,32,34)

HIDE SMILES / InChI

Molecular Formula C28H32Cl2N6
Molecular Weight 523.5
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:40:10 UTC 2023
Edited
by admin
on Sat Dec 16 12:40:10 UTC 2023
Record UNII
HT3GAD2SCM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
WR-3863
Code English
NSC-129790
Code English
RP-12278
Code English
1,4-BIS(2-(7-CHLORO-4-QUINOLYLAMINO)PROPYL)PIPERAZINE
Systematic Name English
BIS((CHLORO-7''-QUINOLYL-4'')AMINO-2'-PROPYL)-1,4-PIPERAZINE DICHLORQUINAZINE
Systematic Name English
1,4-PIPERAZINEDIETHANAMINE, N1,N4-BIS(7-CHLORO-4-QUINOLINYL)-.ALPHA.1,.ALPHA.4-DIMETHYL-
Systematic Name English
Code System Code Type Description
NSC
129790
Created by admin on Sat Dec 16 12:40:10 UTC 2023 , Edited by admin on Sat Dec 16 12:40:10 UTC 2023
PRIMARY
PUBCHEM
31776
Created by admin on Sat Dec 16 12:40:10 UTC 2023 , Edited by admin on Sat Dec 16 12:40:10 UTC 2023
PRIMARY
FDA UNII
HT3GAD2SCM
Created by admin on Sat Dec 16 12:40:10 UTC 2023 , Edited by admin on Sat Dec 16 12:40:10 UTC 2023
PRIMARY
EPA CompTox
DTXSID70909556
Created by admin on Sat Dec 16 12:40:10 UTC 2023 , Edited by admin on Sat Dec 16 12:40:10 UTC 2023
PRIMARY
CAS
10547-40-7
Created by admin on Sat Dec 16 12:40:10 UTC 2023 , Edited by admin on Sat Dec 16 12:40:10 UTC 2023
PRIMARY
ECHA (EC/EINECS)
234-130-6
Created by admin on Sat Dec 16 12:40:10 UTC 2023 , Edited by admin on Sat Dec 16 12:40:10 UTC 2023
PRIMARY
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SALT/SOLVATE -> PARENT
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ACTIVE MOIETY