4-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
4-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carboxamide
4-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | Y041-3342 |
| Compound Name: | 4-methyl-N-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 459.45 |
| Molecular Formula: | C21 H16 F3 N5 O2 S |
| Smiles: | Cc1c(C(Nc2ccc(Cn3cncn3)cc2)=O)sc(c2ccc(cc2)OC(F)(F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4169 |
| logD: | 4.4169 |
| logSw: | -4.2317 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.554 |
| InChI Key: | HBPVMFZRLSKDBB-UHFFFAOYSA-N |