4-[5-(3-bromophenyl)-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[5-(3-bromophenyl)-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
4-[5-(3-bromophenyl)-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 2085-0050 |
| Compound Name: | 4-[5-(3-bromophenyl)-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid |
| Molecular Weight: | 480.15 |
| Molecular Formula: | C19 H16 Br2 N2 O3 |
| Smiles: | C(CC(N1C(CC(c2ccc(cc2)[Br])=N1)c1cccc(c1)[Br])=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6623 |
| logD: | 1.7129 |
| logSw: | -4.656 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.243 |
| InChI Key: | OOOURKXCCYCGFP-KRWDZBQOSA-N |