2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 8012-7271 |
| Compound Name: | 2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-phenoxyphenyl)acetamide |
| Molecular Weight: | 409.39 |
| Molecular Formula: | C17 H14 F3 N5 O2 S |
| Smiles: | C(C(Nc1ccc(cc1)Oc1ccccc1)=O)Sc1nnc(C(F)(F)F)n1N |
| Stereo: | ACHIRAL |
| logP: | 3.2243 |
| logD: | 3.2243 |
| logSw: | -3.686 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.308 |
| InChI Key: | JDIHAEVJBFURJJ-UHFFFAOYSA-N |