3,3-dimethyl-N-(4-{3-[(propan-2-yl)oxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)butanamide
Chemical Structure Depiction of
3,3-dimethyl-N-(4-{3-[(propan-2-yl)oxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)butanamide
3,3-dimethyl-N-(4-{3-[(propan-2-yl)oxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)butanamide
Compound characteristics
| Compound ID: | V009-8004 |
| Compound Name: | 3,3-dimethyl-N-(4-{3-[(propan-2-yl)oxy]-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)butanamide |
| Molecular Weight: | 460.5 |
| Molecular Formula: | C24 H27 F3 N4 O2 |
| Smiles: | CC(C)Oc1nc(c2cccc(c2)C(F)(F)F)n(c2ccc(cc2)NC(CC(C)(C)C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.4969 |
| logD: | 6.4969 |
| logSw: | -5.7888 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.642 |
| InChI Key: | CIGDNPWPYWWYNL-UHFFFAOYSA-N |