6-bromo-3-[5-(2-methoxyphenyl)-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
Chemical Structure Depiction of
6-bromo-3-[5-(2-methoxyphenyl)-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
6-bromo-3-[5-(2-methoxyphenyl)-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | 0590-0563 |
| Compound Name: | 6-bromo-3-[5-(2-methoxyphenyl)-1-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenylquinolin-2(1H)-one |
| Molecular Weight: | 636.59 |
| Molecular Formula: | C36 H34 Br N3 O3 |
| Smiles: | COc1ccccc1C1CC(C2=C(c3ccccc3)c3cc(ccc3NC2=O)[Br])=NN1C(C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 8.8456 |
| logD: | 8.808 |
| logSw: | -5.8208 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.384 |
| InChI Key: | DEOZPUAMHPGHTG-JBKZFBNGSA-N |