3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
Compound ID: | 5756-2349 |
Compound Name: | 3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-{[(furan-2-yl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one |
Molecular Weight: | 440.54 |
Molecular Formula: | C21 H20 N4 O3 S2 |
Smiles: | CCC(C)N1C(/C(=C/C2=C(NCc3ccco3)N=C3C=CC=CN3C2=O)SC1=S)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.2995 |
logD: | 3.2958 |
logSw: | -3.5168 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.511 |
InChI Key: | STYQLCBBXVVHAK-ZDUSSCGKSA-N |