N-[4-(piperidine-1-carbonyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[4-(piperidine-1-carbonyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
N-[4-(piperidine-1-carbonyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D513-0274 |
| Compound Name: | N-[4-(piperidine-1-carbonyl)phenyl]-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 345.42 |
| Molecular Formula: | C16 H19 N5 O2 S |
| Smiles: | C1CCN(CC1)C(c1ccc(cc1)NC(CSc1nnc[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6512 |
| logD: | 0.2967 |
| logSw: | -2.1295 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.19 |
| InChI Key: | YXEWTHGTFTZCPX-UHFFFAOYSA-N |