5-[3-(4-bromophenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
Chemical Structure Depiction of
5-[3-(4-bromophenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
5-[3-(4-bromophenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
Compound characteristics
| Compound ID: | 3336-0956 |
| Compound Name: | 5-[3-(4-bromophenyl)-5-(3,4-dimethoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid |
| Molecular Weight: | 475.34 |
| Molecular Formula: | C22 H23 Br N2 O5 |
| Smiles: | COc1ccc(cc1OC)C1CC(c2ccc(cc2)[Br])=NN1C(CCCC(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6318 |
| logD: | 1.0346 |
| logSw: | -3.9068 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.503 |
| InChI Key: | IMKLEJIRVSBUEG-GOSISDBHSA-N |