Compound C20H22Cl2N4O2

2-amino-2-[5-[bis(2-chloroethyl)amino]-1-phenylbenzimidazol-2-yl]propanoic acid

CAS: 73712-01-3

Molecular Formula	`C20H22Cl2N4O2`
Molecular Weight	421.3 g/mol
LogP	1.0
Topological Polar Surface Area	84.4 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	8
Exact Mass	420.11197
Heavy Atoms	28
Complexity	528.0

Chemical Identifiers

CAS Number	73712-01-3
SMILES	`CC(C1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)N(CCCl)CCCl)(C(=O)O)N`
InChIKey	`FACRTCMVSZCHCJ-UHFFFAOYSA-N`

📖 Product Overview

Compound C20H22Cl2N4O2 (CAS: 73712-01-3) is a chemical compound with molecular formula C20H22Cl2N4O2 and molecular weight 421.3 g/mol. Its IUPAC systematic name is 2-amino-2-[5-[bis(2-chloroethyl)amino]-1-phenylbenzimidazol-2-yl]propanoic acid. LogP 1.0 Topological Polar Surface Area 84.4 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 8 Exact Mass 420.11197 Heavy Atoms 28 Complexity 528.0 InChI Key: FACRTCMVSZCHCJ-UHFFFAOYSA-N. SMILES: CC(C1=NC2=C(N1C3=CC=CC=C3)C=CC(=C2)N(CCCl)CCCl)(C(=O)O)N.

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