4-[5-(2-chloro-7-methylquinolin-3-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[5-(2-chloro-7-methylquinolin-3-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[5-(2-chloro-7-methylquinolin-3-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 3337-2480 |
| Compound Name: | 4-[5-(2-chloro-7-methylquinolin-3-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
| Molecular Weight: | 427.91 |
| Molecular Formula: | C21 H18 Cl N3 O3 S |
| Smiles: | Cc1ccc2cc(C3CC(c4cccs4)=NN3C(CCC(O)=O)=O)c(nc2c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.251 |
| logD: | 1.3016 |
| logSw: | -4.3099 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.229 |
| InChI Key: | DBMNBIAZHULRQA-KRWDZBQOSA-N |