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Details

Stereochemistry ACHIRAL
Molecular Formula C15H19Cl2N3O2
Molecular Weight 344.236
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-DESMETHYLBENDAMUSTINE

SMILES

OC(=O)CCCC1=NC2=C(N1)C=CC(=C2)N(CCCl)CCCl

InChI

InChIKey=BPZIKXXNXMYQPN-UHFFFAOYSA-N
InChI=1S/C15H19Cl2N3O2/c16-6-8-20(9-7-17)11-4-5-12-13(10-11)19-14(18-12)2-1-3-15(21)22/h4-5,10H,1-3,6-9H2,(H,18,19)(H,21,22)

HIDE SMILES / InChI

Molecular Formula C15H19Cl2N3O2
Molecular Weight 344.236
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:33:59 UTC 2023
Edited
by admin
on Sat Dec 16 09:33:59 UTC 2023
Record UNII
542SRM4E31
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-DESMETHYLBENDAMUSTINE
Common Name English
1H-BENZIMIDAZOLE-2-BUTANOIC ACID, 6-(BIS(2-CHLOROETHYL)AMINO)-
Systematic Name English
BENDAMUSTINE (M4)
Systematic Name English
Code System Code Type Description
FDA UNII
542SRM4E31
Created by admin on Sat Dec 16 09:33:59 UTC 2023 , Edited by admin on Sat Dec 16 09:33:59 UTC 2023
PRIMARY
PUBCHEM
24882536
Created by admin on Sat Dec 16 09:33:59 UTC 2023 , Edited by admin on Sat Dec 16 09:33:59 UTC 2023
PRIMARY
CAS
41515-13-3
Created by admin on Sat Dec 16 09:33:59 UTC 2023 , Edited by admin on Sat Dec 16 09:33:59 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> METABOLITE ACTIVE
PLASMA