3-cyano-N-(2-{5-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-cyano-N-(2-{5-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
3-cyano-N-(2-{5-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-1263 |
| Compound Name: | 3-cyano-N-(2-{5-[(3-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}ethyl)benzene-1-sulfonamide |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C18 H16 F N5 O2 S |
| Smiles: | C(CNS(c1cccc(C#N)c1)(=O)=O)c1nc(Cc2cccc(c2)F)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8601 |
| logD: | 2.8587 |
| logSw: | -3.4776 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.66 |
| InChI Key: | WOMJQXGGOGFUMK-UHFFFAOYSA-N |