[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | D054-0034 |
| Compound Name: | [5-chloro-2-(methylsulfanyl)pyrimidin-4-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 383.3 |
| Molecular Formula: | C16 H16 Cl2 N4 O S |
| Smiles: | CSc1ncc(c(C(N2CCN(CC2)c2cccc(c2)[Cl])=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7093 |
| logD: | 3.7093 |
| logSw: | -3.8171 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.732 |
| InChI Key: | KGLCOTOKDFRUBS-UHFFFAOYSA-N |