N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzene-1-sulfonamide
N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V025-0052 |
| Compound Name: | N-{4-[3-ethoxy-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H21 F N4 O3 S |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2cccc(c2)F)n(c2ccc(cc2)NS(c2ccc(C)cc2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6456 |
| logD: | 5.6233 |
| logSw: | -5.526 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.463 |
| InChI Key: | ONFGEIYPEWRXIM-UHFFFAOYSA-N |