4-[3'-(4-methylphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[3'-(4-methylphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl]-4-oxobutanoic acid
4-[3'-(4-methylphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 3337-2514 |
| Compound Name: | 4-[3'-(4-methylphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl]-4-oxobutanoic acid |
| Molecular Weight: | 484.58 |
| Molecular Formula: | C27 H24 N4 O3 S |
| Smiles: | Cc1ccc(cc1)c1c(cn(c2ccccc2)n1)C1CC(c2cccs2)=NN1C(CCC(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8033 |
| logD: | 1.8539 |
| logSw: | -4.3916 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.894 |
| InChI Key: | MQTLYRIPLSBFOX-HSZRJFAPSA-N |