N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,4-difluorobenzene-1-sulfonamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,4-difluorobenzene-1-sulfonamide
N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,4-difluorobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | D439-0377 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-3-yl}-3,4-difluorobenzene-1-sulfonamide |
| Molecular Weight: | 384.79 |
| Molecular Formula: | C15 H11 Cl F2 N4 O2 S |
| Smiles: | C(c1ccc(cc1)[Cl])n1cnc(NS(c2ccc(c(c2)F)F)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3517 |
| logD: | 1.0137 |
| logSw: | -3.6622 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.11 |
| InChI Key: | MMGRCUUHVFLHCE-UHFFFAOYSA-N |