7-methyl-2-{[(4-methylphenyl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
7-methyl-2-{[(4-methylphenyl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
7-methyl-2-{[(4-methylphenyl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-0683 |
| Compound Name: | 7-methyl-2-{[(4-methylphenyl)methyl]amino}-3-{[4-oxo-3-(2-phenylethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 526.68 |
| Molecular Formula: | C29 H26 N4 O2 S2 |
| Smiles: | CC1C=CC2=NC(=C(/C=C3/C(N(CCc4ccccc4)C(=S)S3)=O)C(N2C=1)=O)NCc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8071 |
| logD: | 4.8047 |
| logSw: | -4.5377 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.683 |
| InChI Key: | ZDFGYRWATAQNMY-UHFFFAOYSA-N |