N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-3-fluorobenzamide
N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | C301-9194 |
| Compound Name: | N-[2-({5-bromo-4-[(4-fluorophenyl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)phenyl]-3-fluorobenzamide |
| Molecular Weight: | 501.35 |
| Molecular Formula: | C22 H15 Br F2 N4 O S |
| Smiles: | C(c1ccc(cc1)F)n1c(nnc1[Br])Sc1ccccc1NC(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2285 |
| logD: | 5.2285 |
| logSw: | -5.3034 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.234 |
| InChI Key: | JDVVZGSRRYXTGF-UHFFFAOYSA-N |