5-bromo-2-(difluoromethoxy)-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]benzamide
Chemical Structure Depiction of
5-bromo-2-(difluoromethoxy)-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]benzamide
5-bromo-2-(difluoromethoxy)-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]benzamide
Compound characteristics
| Compound ID: | Y500-8455 |
| Compound Name: | 5-bromo-2-(difluoromethoxy)-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]benzamide |
| Molecular Weight: | 407.23 |
| Molecular Formula: | C13 H13 Br F2 N4 O2 S |
| Smiles: | CCSc1nnc(C)n1NC(c1cc(ccc1OC(F)F)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5504 |
| logD: | 2.5504 |
| logSw: | -3.058 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.331 |
| InChI Key: | UEWUFEGLHREEQY-UHFFFAOYSA-N |