N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide
Compound characteristics
| Compound ID: | V025-4458 |
| Compound Name: | N-{4-[3-ethoxy-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-3-methylbutanamide |
| Molecular Weight: | 370.47 |
| Molecular Formula: | C19 H22 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccs2)n(c2ccc(cc2)NC(CC(C)C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6746 |
| logD: | 4.6746 |
| logSw: | -4.2046 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.981 |
| InChI Key: | KUWOMADJTPJJMA-UHFFFAOYSA-N |