1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-ethoxyphenyl)methyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-ethoxyphenyl)methyl]piperidine-4-carboxamide
1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-ethoxyphenyl)methyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M779-0606 |
| Compound Name: | 1-{6-[(2,5-dimethylphenyl)sulfanyl]pyrimidin-4-yl}-N-[(2-ethoxyphenyl)methyl]piperidine-4-carboxamide |
| Molecular Weight: | 476.64 |
| Molecular Formula: | C27 H32 N4 O2 S |
| Smiles: | CCOc1ccccc1CNC(C1CCN(CC1)c1cc(ncn1)Sc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0194 |
| logD: | 6.019 |
| logSw: | -5.3611 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.677 |
| InChI Key: | TXCUDHNSVZRWTE-UHFFFAOYSA-N |