5-[5-(4-bromophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
Chemical Structure Depiction of
5-[5-(4-bromophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
5-[5-(4-bromophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid
Compound characteristics
| Compound ID: | 3336-0967 |
| Compound Name: | 5-[5-(4-bromophenyl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-5-oxopentanoic acid |
| Molecular Weight: | 429.31 |
| Molecular Formula: | C21 H21 Br N2 O3 |
| Smiles: | Cc1ccc(cc1)C1CC(c2ccc(cc2)[Br])N(C(CCCC(O)=O)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3912 |
| logD: | 1.794 |
| logSw: | -4.2739 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.243 |
| InChI Key: | WAEJPRMGOIJFBQ-IBGZPJMESA-N |