AC1O0ULC structure

AC1O0ULC

ethyl 4-[3-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylate

Also Known As: ethyl 4-{3-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperazine-1-carboxylate|(Z)-ethyl 4-(3-((3-benzyl-4-oxo-2-thioxothiazolidin-5-ylidene)methyl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperazine-1-carboxylate|ethyl 4-(9-methyl-4-oxo-3-{[4-oxo-3-benzyl-2-thioxo(1,3-thiazolidin-5-ylidene) ]methyl}-5-hydropyridino[1,2-a]pyrimidin-2-yl)piperazinecarboxylate|ethyl 4-[3-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperazine-1-carboxylate

CAS: 607692-98-8
Molecular Formula C27H27N5O4S2
Molecular Weight 549.15045 g/mol
LogP 3.68282
Topological Polar Surface Area 87.46 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 5
Exact Mass 549.15045
Monoisotopic Mass 549.15045
Heavy Atoms 38
Complexity 1496.584

Chemical Identifiers

CAS Number 607692-98-8
SMILES CCOC(=O)N1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CC5=CC=CC=C5

Product Overview

AC1O0ULC (CAS 607692-98-8), with molecular formula C27H27N5O4S2 and molecular weight 549.15045 g/mol. IUPAC: ethyl 4-[3-[(Z)-(3-benzyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl]piperazine-1-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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