4-[3-(4-bromophenyl)-5-(2-chloro-7-methylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[3-(4-bromophenyl)-5-(2-chloro-7-methylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[3-(4-bromophenyl)-5-(2-chloro-7-methylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 2294-0034 |
| Compound Name: | 4-[3-(4-bromophenyl)-5-(2-chloro-7-methylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
| Molecular Weight: | 500.78 |
| Molecular Formula: | C23 H19 Br Cl N3 O3 |
| Smiles: | Cc1ccc2cc(C3CC(c4ccc(cc4)[Br])=NN3C(CCC(O)=O)=O)c(nc2c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.248 |
| logD: | 2.2985 |
| logSw: | -5.465 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.211 |
| InChI Key: | BLLZEBGKJDJUFM-HXUWFJFHSA-N |