4-tert-butyl-N-(3-{1-[3-chloro-4-(trifluoromethyl)phenyl]-5-methyl-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
Chemical Structure Depiction of
4-tert-butyl-N-(3-{1-[3-chloro-4-(trifluoromethyl)phenyl]-5-methyl-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
4-tert-butyl-N-(3-{1-[3-chloro-4-(trifluoromethyl)phenyl]-5-methyl-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide
Compound characteristics
| Compound ID: | C200-4851 |
| Compound Name: | 4-tert-butyl-N-(3-{1-[3-chloro-4-(trifluoromethyl)phenyl]-5-methyl-1H-1,2,3-triazol-4-yl}-1,2,4-thiadiazol-5-yl)benzamide |
| Molecular Weight: | 520.96 |
| Molecular Formula: | C23 H20 Cl F3 N6 O S |
| Smiles: | Cc1c(c2nc(NC(c3ccc(cc3)C(C)(C)C)=O)sn2)nnn1c1ccc(c(c1)[Cl])C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.7124 |
| logD: | 6.7071 |
| logSw: | -6.4166 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.76 |
| InChI Key: | ODTJRDZWMWCBQO-UHFFFAOYSA-N |