4-[4-(3-bromobenzamido)phenyl]-1-(4-methylphenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
4-[4-(3-bromobenzamido)phenyl]-1-(4-methylphenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl acetate
4-[4-(3-bromobenzamido)phenyl]-1-(4-methylphenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V011-6881 |
| Compound Name: | 4-[4-(3-bromobenzamido)phenyl]-1-(4-methylphenyl)-3-(propan-2-yl)-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 532.44 |
| Molecular Formula: | C28 H26 Br N3 O3 |
| Smiles: | CC(C)c1c(c2ccc(cc2)NC(c2cccc(c2)[Br])=O)c(n(c2ccc(C)cc2)n1)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.256 |
| logD: | 7.2556 |
| logSw: | -5.7358 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.937 |
| InChI Key: | WXIYNZFYDNTARN-UHFFFAOYSA-N |