Compound C22H27Cl3FN3O

7-chloro-1-[3-(diethylamino)propyl]-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one;dihydrochloride

CAS: 4130-75-0

Molecular Formula	`C22H27Cl3FN3O`
Molecular Weight	474.8 g/mol
Topological Polar Surface Area	35.9 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	473.12036
Heavy Atoms	30
Complexity	554.0

Chemical Identifiers

CAS Number	4130-75-0
SMILES	`CCN(CC)CCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F.Cl.Cl`
InChIKey	`QUYLCUGBYNYTMQ-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H27Cl3FN3O (CAS: 4130-75-0) is a chemical compound with molecular formula C22H27Cl3FN3O and molecular weight 474.8 g/mol. Its IUPAC systematic name is 7-chloro-1-[3-(diethylamino)propyl]-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one;dihydrochloride. Topological Polar Surface Area 35.9 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 7 Exact Mass 473.12036 Heavy Atoms 30 Complexity 554.0 InChI Key: QUYLCUGBYNYTMQ-UHFFFAOYSA-N. SMILES: CCN(CC)CCCN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F.Cl.Cl.

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