2-bromo-N-(4-{5-(2-methylphenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)benzamide
Chemical Structure Depiction of
2-bromo-N-(4-{5-(2-methylphenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)benzamide
2-bromo-N-(4-{5-(2-methylphenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)benzamide
Compound characteristics
| Compound ID: | V011-9094 |
| Compound Name: | 2-bromo-N-(4-{5-(2-methylphenyl)-3-[(propan-2-yl)oxy]-1H-1,2,4-triazol-1-yl}phenyl)benzamide |
| Molecular Weight: | 491.39 |
| Molecular Formula: | C25 H23 Br N4 O2 |
| Salt: | not_available |
| Smiles: | CC(C)Oc1nc(c2ccccc2C)n(c2ccc(cc2)NC(c2ccccc2[Br])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.8559 |
| logD: | 5.8551 |
| logSw: | -5.4964 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.584 |
| InChI Key: | HJMJXCDNGZRYTF-UHFFFAOYSA-N |