AC1LU98I structure

AC1LU98I

(5Z)-5-[[2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: 2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-3-{(Z)-[3-(2-methylpropyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one|(Z)-5-((2-(4-(2-fluorophenyl)piperazin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-3-isobutyl-2-thioxothiazolidin-4-one|(5Z)-5-[[2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methylpropyl)-2-sulfanylidene-1,3-thiazolidin-4-one|5-({2-[4-(2-fluorophenyl)piperazinyl]-9-methyl-4-oxo(5-hydropyridino[1,2-a]pyr imidin-3-yl)}methylene)-3-(2-methylpropyl)-2-thioxo-1,3-thiazolidin-4-one

CAS: 617675-08-8
Molecular Formula C27H28FN5O2S2
Molecular Weight 537.1669 g/mol
LogP 4.32582
Topological Polar Surface Area 61.16 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 537.1669
Monoisotopic Mass 537.1669
Heavy Atoms 37
Complexity 1477.3882

Chemical Identifiers

CAS Number 617675-08-8
SMILES CC1=CC=CN2C1=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CC(C)C)N4CCN(CC4)C5=CC=CC=C5F

Product Overview

AC1LU98I (CAS 617675-08-8), with molecular formula C27H28FN5O2S2 and molecular weight 537.1669 g/mol. IUPAC: (5Z)-5-[[2-[4-(2-fluorophenyl)piperazin-1-yl]-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]methylidene]-3-(2-methylpropyl)-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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