Compound C13H10ClN3O

7-chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-one

CAS: 30195-30-3

Molecular Formula	`C13H10ClN3O`
Molecular Weight	259.69 g/mol
LogP	1.5
Topological Polar Surface Area	57.3 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	1
Exact Mass	259.05124
Heavy Atoms	18
Complexity	371.0

Chemical Identifiers

CAS Number	30195-30-3
SMILES	`C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CN3`
InChIKey	`XWNMORIHKRROGW-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H10ClN3O (CAS: 30195-30-3) is a chemical compound with molecular formula C13H10ClN3O and molecular weight 259.69 g/mol. Its IUPAC systematic name is 7-chloro-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-one. LogP 1.5 Topological Polar Surface Area 57.3 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 1 Exact Mass 259.05124 Heavy Atoms 18 Complexity 371.0 InChI Key: XWNMORIHKRROGW-UHFFFAOYSA-N. SMILES: C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CN3.

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