AC1O0SYW structure

AC1O0SYW

(5Z)-3-butan-2-yl-5-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: 3-{(Z)-[3-(butan-2-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-[4-(2-methoxyphenyl)piperazin-1-yl]-4H-pyrido[1,2-a]pyrimidin-4-one|(5Z)-3-butan-2-yl-5-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one|(Z)-3-(sec-butyl)-5-((2-(4-(2-methoxyphenyl)piperazin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one|5-({2-[4-(2-methoxyphenyl)piperazinyl]-4-oxo(5-hydropyridino[1,2-a]pyrimidin-3 -yl)}methylene)-3-(methylpropyl)-2-thioxo-1,3-thiazolidin-4-one

CAS: 488724-75-0
Molecular Formula C27H29N5O3S2
Molecular Weight 535.1712 g/mol
LogP 4.0294
Topological Polar Surface Area 70.39 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 535.1712
Monoisotopic Mass 535.1712
Heavy Atoms 37
Complexity 1445.4724

Chemical Identifiers

CAS Number 488724-75-0
SMILES CCC(C)N1C(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C5=CC=CC=C5OC)/SC1=S

Product Overview

AC1O0SYW (CAS 488724-75-0), with molecular formula C27H29N5O3S2 and molecular weight 535.1712 g/mol. IUPAC: (5Z)-3-butan-2-yl-5-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one.

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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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