N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}butane-1-sulfonamide
Chemical Structure Depiction of
N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}butane-1-sulfonamide
N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}butane-1-sulfonamide
Compound characteristics
| Compound ID: | Y200-5809 |
| Compound Name: | N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}butane-1-sulfonamide |
| Molecular Weight: | 312.36 |
| Molecular Formula: | C13 H17 F N4 O2 S |
| Smiles: | CCCCS(Nc1ncn(Cc2ccc(cc2)F)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3827 |
| logD: | 0.8254 |
| logSw: | -2.9659 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.008 |
| InChI Key: | PWUCEQGADRFZGC-UHFFFAOYSA-N |