N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonamide
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonamide
Compound characteristics
| Compound ID: | D439-0382 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-5-methyl-1H-pyrazole-4-sulfonamide |
| Molecular Weight: | 402.81 |
| Molecular Formula: | C14 H13 Cl F2 N6 O2 S |
| Smiles: | Cc1c(cnn1C(F)F)S(Nc1ncn(Cc2ccc(cc2)[Cl])n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6149 |
| logD: | 0.8217 |
| logSw: | -2.8171 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.696 |
| InChI Key: | PVABOVFEUPPGEG-UHFFFAOYSA-N |