BRN 0895283

8-chloro-5-[2-(dimethylamino)ethyl]-11H-benzo[b][1,4]benzodiazepin-6-one

CAS: 1159-95-1

Molecular Formula	`C17H18ClN3O`
Molecular Weight	315.8 g/mol
LogP	3.2
Topological Polar Surface Area	35.6 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	315.11383
Heavy Atoms	22
Complexity	403.0

Chemical Identifiers

CAS Number	1159-95-1
SMILES	`CN(C)CCN1C2=CC=CC=C2NC3=C(C1=O)C=C(C=C3)Cl`
InChIKey	`WJGBLIUGZFWCJN-UHFFFAOYSA-N`

📖 Product Overview

BRN 0895283 (CAS: 1159-95-1) is a chemical compound with molecular formula C17H18ClN3O and molecular weight 315.8 g/mol. Its IUPAC systematic name is 8-chloro-5-[2-(dimethylamino)ethyl]-11H-benzo[b][1,4]benzodiazepin-6-one. LogP 3.2 Topological Polar Surface Area 35.6 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 315.11383 Heavy Atoms 22 Complexity 403.0 InChI Key: WJGBLIUGZFWCJN-UHFFFAOYSA-N. SMILES: CN(C)CCN1C2=CC=CC=C2NC3=C(C1=O)C=C(C=C3)Cl.

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