AC1NYEFU structure

AC1NYEFU

(5Z)-5-[[2-(4-ethylpiperazin-1-yl)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: 2-(4-ethylpiperazin-1-yl)-7-methyl-3-{(Z)-[4-oxo-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one|(Z)-5-((2-(4-ethylpiperazin-1-yl)-7-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-(3-phenylpropyl)-2-thioxothiazolidin-4-one|(5Z)-5-[[2-(4-ethylpiperazin-1-yl)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(3-phenylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one|5-{[2-(4-ethylpiperazinyl)-7-methyl-4-oxo(5-hydropyridino[1,2-a]pyrimidin-3-yl )]methylene}-3-(3-phenylpropyl)-2-thioxo-1,3-thiazolidin-4-one

CAS: 797016-09-2
Molecular Formula C28H31N5O2S2
Molecular Weight 533.1919 g/mol
LogP 3.97882
Topological Polar Surface Area 61.16 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 533.1919
Monoisotopic Mass 533.1919
Heavy Atoms 37
Complexity 1411.3348

Chemical Identifiers

CAS Number 797016-09-2
SMILES CCN1CCN(CC1)C2=C(C(=O)N3C=C(C=CC3=N2)C)/C=C\4/C(=O)N(C(=S)S4)CCCC5=CC=CC=C5

Product Overview

AC1NYEFU (CAS 797016-09-2), with molecular formula C28H31N5O2S2 and molecular weight 533.1919 g/mol. IUPAC: (5Z)-5-[[2-(4-ethylpiperazin-1-yl)-7-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(3-phenylpropyl)-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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