9-methyl-3-{[3-(2-methylpropyl)-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
9-methyl-3-{[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one
9-methyl-3-{[3-(2-methylpropyl)-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: | 4428-0421 |
| Compound Name: | 9-methyl-3-{[3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 442.6 |
| Molecular Formula: | C22 H26 N4 O2 S2 |
| Smiles: | CC(C)CN1C(/C(=C/C2=C(N=C3C(C)=CC=CN3C2=O)N2CCCCC2)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9334 |
| logD: | 3.9334 |
| logSw: | -3.9116 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 44.528 |
| InChI Key: | RBAVLSBHHLHFIO-UHFFFAOYSA-N |