AC1NT2U9 structure

AC1NT2U9

ethyl (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Also Known As: (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)-2-furyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester|ethyl (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

CAS: 5818-99-5
Molecular Formula C29H25N3O6S
Molecular Weight 543.1464 g/mol
LogP 4.58334
Topological Polar Surface Area 116.94 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 543.1464
Monoisotopic Mass 543.1464
Heavy Atoms 39
Complexity 1828.41

Chemical Identifiers

CAS Number 5818-99-5
SMILES CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)/C(=C/C4=CC=C(O4)C5=CC(=C(C(=C5)C)C)[N+](=O)[O-])/S2)C

Product Overview

AC1NT2U9 (CAS 5818-99-5), with molecular formula C29H25N3O6S and molecular weight 543.1464 g/mol. IUPAC: ethyl (2Z)-2-[[5-(3,4-dimethyl-5-nitrophenyl)furan-2-yl]methylidene]-7-methyl-3-oxo-5-phenyl-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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