5-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
5-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-4-carboxamide
5-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | Y041-3249 |
| Compound Name: | 5-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 459.45 |
| Molecular Formula: | C21 H16 F3 N5 O2 S |
| Smiles: | Cc1c(C(Nc2ccc(Cn3cncn3)cc2)=O)nc(c2ccc(cc2)OC(F)(F)F)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.776 |
| logD: | 4.776 |
| logSw: | -4.4436 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.747 |
| InChI Key: | FTKKEECRQILSLJ-UHFFFAOYSA-N |