1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0640 |
| Compound Name: | 1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 446.61 |
| Molecular Formula: | C26 H30 N4 O S |
| Smiles: | Cc1ccc(C)c(c1)Sc1cc(ncn1)N1CCC(CC1)C(NCc1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.298 |
| logD: | 6.2976 |
| logSw: | -5.4031 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.467 |
| InChI Key: | YOAWPNJPXDWINI-UHFFFAOYSA-N |