AC1NPQBV structure

AC1NPQBV

prop-2-enyl 2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Also Known As: Prop-2-en-1-yl 2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate|prop-2-enyl 2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

CAS: 6997-63-3
Molecular Formula C27H26N2O5S2
Molecular Weight 522.1283 g/mol
LogP 3.7035
Topological Polar Surface Area 79.12 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 8
Exact Mass 522.1283
Monoisotopic Mass 522.1283
Heavy Atoms 36
Complexity 1516.9161

Chemical Identifiers

CAS Number 6997-63-3
SMILES CC1=C(C(N2C(=O)C(=CC3=C(C=C(C=C3)OC)OC)SC2=N1)C4=CC=C(C=C4)SC)C(=O)OCC=C

Product Overview

AC1NPQBV (CAS 6997-63-3), with molecular formula C27H26N2O5S2 and molecular weight 522.1283 g/mol. IUPAC: prop-2-enyl 2-[(2,4-dimethoxyphenyl)methylidene]-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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