2-bromo-N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
Chemical Structure Depiction of
2-bromo-N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
2-bromo-N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide
Compound characteristics
| Compound ID: | V015-1529 |
| Compound Name: | 2-bromo-N-{4-[3-(2-ethoxyethoxy)-5-(3-fluorophenyl)-1H-1,2,4-triazol-1-yl]phenyl}benzamide |
| Molecular Weight: | 525.38 |
| Molecular Formula: | C25 H22 Br F N4 O3 |
| Salt: | not_available |
| Smiles: | CCOCCOc1nc(c2cccc(c2)F)n(c2ccc(cc2)NC(c2ccccc2[Br])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2859 |
| logD: | 5.2851 |
| logSw: | -5.3109 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.176 |
| InChI Key: | KAXWZDOFHFNXOQ-UHFFFAOYSA-N |