N-[4-(difluoromethoxy)phenyl]-2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-(difluoromethoxy)phenyl]-2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-[4-(difluoromethoxy)phenyl]-2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-7743 |
| Compound Name: | N-[4-(difluoromethoxy)phenyl]-2-{[5-methyl-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 379.39 |
| Molecular Formula: | C16 H15 F2 N5 O2 S |
| Smiles: | Cc1nnc(n1n1cccc1)SCC(Nc1ccc(cc1)OC(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0099 |
| logD: | 2.0099 |
| logSw: | -2.5099 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.95 |
| InChI Key: | RWGUNQBDUPPCNK-UHFFFAOYSA-N |