N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Compound characteristics
| Compound ID: | Y502-9936 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-1-(difluoromethyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide |
| Molecular Weight: | 416.83 |
| Molecular Formula: | C15 H15 Cl F2 N6 O2 S |
| Smiles: | Cc1c(c(C)n(C(F)F)n1)S(Nc1ncn(Cc2ccc(cc2)[Cl])n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.781 |
| logD: | 0.3454 |
| logSw: | -2.9064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.049 |
| InChI Key: | IPAPVOLRLJOIIE-UHFFFAOYSA-N |