N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamidehydrate

N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamide;hydrate

CAS: 65872-81-3

Molecular Formula	`C20H22FN3O3`
Molecular Weight	371.4 g/mol
Topological Polar Surface Area	62.8 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	371.16452
Heavy Atoms	27
Complexity	565.0

Chemical Identifiers

CAS Number	65872-81-3
SMILES	`CCCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3C)CF.O`
InChIKey	`YFKYVTSQMSDASF-UHFFFAOYSA-N`

📖 Product Overview

N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamidehydrate (CAS: 65872-81-3) is a chemical compound with molecular formula C20H22FN3O3 and molecular weight 371.4 g/mol. Its IUPAC systematic name is N-[2-(fluoromethyl)-3-(2-methylphenyl)-4-oxoquinazolin-6-yl]butanamide;hydrate. Topological Polar Surface Area 62.8 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 5 Exact Mass 371.16452 Heavy Atoms 27 Complexity 565.0 InChI Key: YFKYVTSQMSDASF-UHFFFAOYSA-N. SMILES: CCCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)C3=CC=CC=C3C)CF.O.

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