(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) 3,4,5-trimethoxybenzoate

CAS: 18035-92-2

Molecular Formula	`C25H21ClN2O6`
Molecular Weight	480.9 g/mol
LogP	4.5
Topological Polar Surface Area	95.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	480.10883
Heavy Atoms	34
Complexity	744.0

Chemical Identifiers

CAS Number	18035-92-2
SMILES	`COC1=CC(=CC(=C1OC)OC)C(=O)OC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4`
InChIKey	`KKBASWQAOUMPNG-UHFFFAOYSA-N`

📖 Product Overview

(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) 3,4,5-trimethoxybenzoate (CAS: 18035-92-2) is a chemical compound with molecular formula C25H21ClN2O6 and molecular weight 480.9 g/mol. Its IUPAC systematic name is (7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl) 3,4,5-trimethoxybenzoate. LogP 4.5 Topological Polar Surface Area 95.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 7 Rotatable Bonds 7 Exact Mass 480.10883 Heavy Atoms 34 Complexity 744.0 InChI Key: KKBASWQAOUMPNG-UHFFFAOYSA-N. SMILES: COC1=CC(=CC(=C1OC)OC)C(=O)OC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4.

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