4-{[1-(4-cyanobenzene-1-sulfonyl)piperidin-4-yl]methyl}-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
4-{[1-(4-cyanobenzene-1-sulfonyl)piperidin-4-yl]methyl}-N-(2-methoxyethyl)benzamide
4-{[1-(4-cyanobenzene-1-sulfonyl)piperidin-4-yl]methyl}-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | S690-1531 |
| Compound Name: | 4-{[1-(4-cyanobenzene-1-sulfonyl)piperidin-4-yl]methyl}-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C23 H27 N3 O4 S |
| Smiles: | COCCNC(c1ccc(CC2CCN(CC2)S(c2ccc(C#N)cc2)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0459 |
| logD: | 3.0459 |
| logSw: | -3.5025 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.603 |
| InChI Key: | HKNFLYXNGFZPJF-UHFFFAOYSA-N |