3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(propylamino)-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}-7-methyl-2-(propylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(propylamino)-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | 4578-1092 |
| Compound Name: | 3-{[3-(butan-2-yl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-7-methyl-2-(propylamino)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 416.56 |
| Molecular Formula: | C20 H24 N4 O2 S2 |
| Smiles: | CCCNC1=C(/C=C2/C(N(C(C)CC)C(=S)S2)=O)C(N2C=C(C)C=CC2=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3098 |
| logD: | 3.3097 |
| logSw: | -3.478 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.394 |
| InChI Key: | RAAOZLXXUQGQLT-ZDUSSCGKSA-N |