N-(3-chloro-4-methoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
N-(3-chloro-4-methoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | P510-0674 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 447.99 |
| Molecular Formula: | C21 H26 Cl N5 O2 S |
| Smiles: | COc1ccc(cc1[Cl])NC(C1CCN(CC1)c1cc(ncn1)N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1761 |
| logD: | 4.1576 |
| logSw: | -4.4185 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.602 |
| InChI Key: | MCQBZYHTKGZUKK-UHFFFAOYSA-N |