N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzene-1-sulfonamide
N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | V012-8107 |
| Compound Name: | N-(3-{3-ethoxy-5-[4-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-fluorobenzene-1-sulfonamide |
| Molecular Weight: | 506.48 |
| Molecular Formula: | C23 H18 F4 N4 O3 S |
| Salt: | not_available |
| Smiles: | CCOc1nc(c2ccc(cc2)C(F)(F)F)n(c2cccc(c2)NS(c2ccc(cc2)F)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.201 |
| logD: | 6.1893 |
| logSw: | -5.7423 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.463 |
| InChI Key: | KCOMXSMJRBRETD-UHFFFAOYSA-N |