4-[4-(4-methylphenyl)-6-oxo-3-phenyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoic acid
Chemical Structure Depiction of
4-[4-(4-methylphenyl)-6-oxo-3-phenyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoic acid
4-[4-(4-methylphenyl)-6-oxo-3-phenyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoic acid
Compound characteristics
| Compound ID: | C390-0161 |
| Compound Name: | 4-[4-(4-methylphenyl)-6-oxo-3-phenyl-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoic acid |
| Molecular Weight: | 409.44 |
| Molecular Formula: | C25 H19 N3 O3 |
| Smiles: | Cc1ccc(cc1)C1c2c(c3ccccc3)n[nH]c2C(N1c1ccc(cc1)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8541 |
| logD: | 2.4589 |
| logSw: | -4.4381 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.935 |
| InChI Key: | WHEACYVMMJXYPE-QHCPKHFHSA-N |