AC1LZIN3

(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-[(9-methyl-4-oxo-2-thiomorpholin-4-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Also Known As: 3-{(Z)-[3-(1,3-benzodioxol-5-ylmethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-9-methyl-2-(thiomorpholin-4-yl)-4H-pyrido[1,2-a]pyrimidin-4-one|(Z)-3-(benzo[d][1,3]dioxol-5-ylmethyl)-5-((9-methyl-4-oxo-2-thiomorpholino-4H-pyrido[1,2-a]pyrimidin-3-yl)methylene)-2-thioxothiazolidin-4-one|(5Z)-3-(1,3-benzodioxol-5-ylmethyl)-5-[(9-methyl-4-oxo-2-thiomorpholin-4-ylpyrido[1,2-a]pyrimidin-3-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one|3-(2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)-5-[(9-methyl-4-oxo-2-(1,4-thiazaper hydroin-4-yl)(5-hydropyridino[1,2-a]pyrimidin-3-yl))methylene]-2-thioxo-1,3-th iazolidin-4-one

Molecular Formula	C25H22N4O4S3
Molecular Weight	538.0803 g/mol
LogP	3.68622
Topological Polar Surface Area	76.38 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	9
Rotatable Bonds	4
Exact Mass	538.0803
Monoisotopic Mass	538.0803
Heavy Atoms	36
Complexity	1496.638

Chemical Identifiers

CAS Number	488709-67-7
SMILES	CC1=CC=CN2C1=NC(=C(C2=O)/C=C\3/C(=O)N(C(=S)S3)CC4=CC5=C(C=C4)OCO5)N6CCSCC6