(4-benzylpiperidin-1-yl)[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]methanone
Chemical Structure Depiction of
(4-benzylpiperidin-1-yl)[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]methanone
(4-benzylpiperidin-1-yl)[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]methanone
Compound characteristics
| Compound ID: | D054-0037 |
| Compound Name: | (4-benzylpiperidin-1-yl)[5-chloro-2-(methylsulfanyl)pyrimidin-4-yl]methanone |
| Molecular Weight: | 361.89 |
| Molecular Formula: | C18 H20 Cl N3 O S |
| Smiles: | CSc1ncc(c(C(N2CCC(CC2)Cc2ccccc2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.4613 |
| logD: | 4.4613 |
| logSw: | -4.4032 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.201 |
| InChI Key: | YCNONRIDIMCKBC-UHFFFAOYSA-N |