3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-{[(4-methoxyphenyl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-{[(4-methoxyphenyl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-{[(4-methoxyphenyl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0705 |
| Compound Name: | 3-({3-[(furan-2-yl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-{[(4-methoxyphenyl)methyl]amino}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 504.59 |
| Molecular Formula: | C25 H20 N4 O4 S2 |
| Smiles: | COc1ccc(CNC2=C(/C=C3/C(N(Cc4ccco4)C(=S)S3)=O)C(N3C=CC=CC3=N2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.2163 |
| logD: | 3.216 |
| logSw: | -3.4132 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.478 |
| InChI Key: | KNGOLDGHBUBGKN-UHFFFAOYSA-N |