4-[4-(3-bromobenzamido)phenyl]-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
4-[4-(3-bromobenzamido)phenyl]-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate
4-[4-(3-bromobenzamido)phenyl]-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V016-9014 |
| Compound Name: | 4-[4-(3-bromobenzamido)phenyl]-3-cyclopropyl-1-phenyl-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 516.39 |
| Molecular Formula: | C27 H22 Br N3 O3 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(c2cccc(c2)[Br])=O)c(C2CC2)nn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.506 |
| logD: | 6.5057 |
| logSw: | -5.7472 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.188 |
| InChI Key: | KBRZUVZASIDVND-UHFFFAOYSA-N |