Compound C19H23Cl3FN3O

3-[7-chloro-5-(2-fluorophenyl)-2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-4-ium-1-yl]propyl-methylazanium dichloride

CAS: 4191-05-3

Molecular Formula	`C19H23Cl3FN3O`
Molecular Weight	434.8 g/mol
Topological Polar Surface Area	53.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	5
Exact Mass	433.08908
Heavy Atoms	27
Complexity	452.0

Chemical Identifiers

CAS Number	4191-05-3
SMILES	`C[NH2+]CCCN1C(=O)C[NH2+]C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F.[Cl-].[Cl-]`
InChIKey	`ANSDFYDJRIUSGG-UHFFFAOYSA-N`

📖 Product Overview

Compound C19H23Cl3FN3O (CAS: 4191-05-3) is a chemical compound with molecular formula C19H23Cl3FN3O and molecular weight 434.8 g/mol. Its IUPAC systematic name is 3-[7-chloro-5-(2-fluorophenyl)-2-oxo-4,5-dihydro-3H-1,4-benzodiazepin-4-ium-1-yl]propyl-methylazanium dichloride. Topological Polar Surface Area 53.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 4 Rotatable Bonds 5 Exact Mass 433.08908 Heavy Atoms 27 Complexity 452.0 InChI Key: ANSDFYDJRIUSGG-UHFFFAOYSA-N. SMILES: C[NH2+]CCCN1C(=O)C[NH2+]C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3F.[Cl-].[Cl-].

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