1-(4-methylbenzene-1-sulfonyl)-N-[2-(5-phenyl-1H-1,2,4-triazol-3-yl)ethyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(4-methylbenzene-1-sulfonyl)-N-[2-(5-phenyl-1H-1,2,4-triazol-3-yl)ethyl]piperidine-4-carboxamide
1-(4-methylbenzene-1-sulfonyl)-N-[2-(5-phenyl-1H-1,2,4-triazol-3-yl)ethyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G717-1381 |
| Compound Name: | 1-(4-methylbenzene-1-sulfonyl)-N-[2-(5-phenyl-1H-1,2,4-triazol-3-yl)ethyl]piperidine-4-carboxamide |
| Molecular Weight: | 453.56 |
| Molecular Formula: | C23 H27 N5 O3 S |
| Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)C(NCCc1nc(c2ccccc2)[nH]n1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9183 |
| logD: | 2.9059 |
| logSw: | -3.3378 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.98 |
| InChI Key: | NLVKMIYIVSCNEZ-UHFFFAOYSA-N |