2-{5-[3-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl}aniline
Chemical Structure Depiction of
2-{5-[3-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl}aniline
2-{5-[3-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl}aniline
Compound characteristics
| Compound ID: | H024-0166 |
| Compound Name: | 2-{5-[3-(trifluoromethoxy)phenyl]-1H-1,2,4-triazol-3-yl}aniline |
| Molecular Weight: | 320.27 |
| Molecular Formula: | C15 H11 F3 N4 O |
| Smiles: | c1ccc(c(c1)c1nc(c2cccc(c2)OC(F)(F)F)[nH]n1)N |
| Stereo: | ACHIRAL |
| logP: | 4.2875 |
| logD: | 4.2382 |
| logSw: | -4.5926 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 59.785 |
| InChI Key: | AJIHZJLAAGDLND-UHFFFAOYSA-N |