4-tert-butyl-N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]benzamide
4-tert-butyl-N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]benzamide
Compound characteristics
| Compound ID: | F938-0065 |
| Compound Name: | 4-tert-butyl-N-[2-({3-chloro-1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-5-yl}sulfanyl)phenyl]benzamide |
| Molecular Weight: | 495.02 |
| Molecular Formula: | C26 H24 Cl F N4 O S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1ccccc1Sc1nc(nn1Cc1ccc(cc1)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.8785 |
| logD: | 6.8785 |
| logSw: | -6.3249 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.462 |
| InChI Key: | MGLICQQHNDZWFR-UHFFFAOYSA-N |