7-methyl-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-methyl-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
7-methyl-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0974 |
| Compound Name: | 7-methyl-3-({3-[(4-methylphenyl)methyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene}methyl)-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 490.65 |
| Molecular Formula: | C26 H26 N4 O2 S2 |
| Smiles: | CC1C=CC2=NC(=C(/C=C3/C(N(Cc4ccc(C)cc4)C(=S)S3)=O)C(N2C=1)=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.7514 |
| logD: | 4.7514 |
| logSw: | -4.3748 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.755 |
| InChI Key: | ZLQXMIWXSIXZOJ-UHFFFAOYSA-N |