2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]acetamide
2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | J016-0070 |
| Compound Name: | 2-[4-methyl-2-(4H-1,2,4-triazol-4-yl)phenoxy]-N-[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 461.44 |
| Molecular Formula: | C22 H22 F3 N5 O3 |
| Smiles: | Cc1ccc(c(c1)n1cnnc1)OCC(Nc1cc(ccc1N1CCOCC1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2791 |
| logD: | 2.981 |
| logSw: | -3.4572 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.795 |
| InChI Key: | NCKAQEIETUXOJS-UHFFFAOYSA-N |