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Details

Stereochemistry ACHIRAL
Molecular Formula C30H24Cl2N6
Molecular Weight 539.458
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 11,11-(PIPERAZINE-1,4-DIYL)BIS(8-CHLORO-5H-DIBENZO(B,E)(1,4)DIAZEPINE)

SMILES

ClC1=CC2=C(NC3=CC=CC=C3C(=N2)N4CCN(CC4)C5=NC6=CC(Cl)=CC=C6NC7=C5C=CC=C7)C=C1

InChI

InChIKey=IDGKXLZQFLSYEI-UHFFFAOYSA-N
InChI=1S/C30H24Cl2N6/c31-19-9-11-25-27(17-19)35-29(21-5-1-3-7-23(21)33-25)37-13-15-38(16-14-37)30-22-6-2-4-8-24(22)34-26-12-10-20(32)18-28(26)36-30/h1-12,17-18,33-34H,13-16H2

HIDE SMILES / InChI

Molecular Formula C30H24Cl2N6
Molecular Weight 539.458
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:38:58 UTC 2023
Edited
by admin
on Thu Jul 06 23:38:58 UTC 2023
Record UNII
AI23QM53UB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
11,11-(PIPERAZINE-1,4-DIYL)BIS(8-CHLORO-5H-DIBENZO(B,E)(1,4)DIAZEPINE)
Systematic Name English
5H-DIBENZO(B,E)(1,4)DIAZEPINE, 11,11'-(1,4-PIPERAZINEDIYL)BIS(8-CHLORO-
Systematic Name English
CLOZAPINE IMPURITY B [USP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
AI23QM53UB
Created by admin on Thu Jul 06 23:38:58 UTC 2023 , Edited by admin on Thu Jul 06 23:38:58 UTC 2023
PRIMARY
CAS
263366-81-0
Created by admin on Thu Jul 06 23:38:58 UTC 2023 , Edited by admin on Thu Jul 06 23:38:58 UTC 2023
PRIMARY
PUBCHEM
135398959
Created by admin on Thu Jul 06 23:38:58 UTC 2023 , Edited by admin on Thu Jul 06 23:38:58 UTC 2023
PRIMARY
EPA CompTox
DTXSID80373007
Created by admin on Thu Jul 06 23:38:58 UTC 2023 , Edited by admin on Thu Jul 06 23:38:58 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP