1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0600 |
| Compound Name: | 1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C26 H30 N4 O S |
| Smiles: | Cc1ccc(CNC(C2CCN(CC2)c2cc(ncn2)Sc2cc(C)ccc2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8334 |
| logD: | 5.833 |
| logSw: | -5.3413 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.467 |
| InChI Key: | IVZPWZWZLQCQOH-UHFFFAOYSA-N |