ethyl 4-{6-oxo-3-phenyl-4-[4-(propan-2-yl)phenyl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{6-oxo-3-phenyl-4-[4-(propan-2-yl)phenyl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}benzoate
ethyl 4-{6-oxo-3-phenyl-4-[4-(propan-2-yl)phenyl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}benzoate
Compound characteristics
| Compound ID: | C390-0333 |
| Compound Name: | ethyl 4-{6-oxo-3-phenyl-4-[4-(propan-2-yl)phenyl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl}benzoate |
| Molecular Weight: | 465.55 |
| Molecular Formula: | C29 H27 N3 O3 |
| Smiles: | CCOC(c1ccc(cc1)N1C(c2ccc(cc2)C(C)C)c2c(c3ccccc3)n[nH]c2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5221 |
| logD: | 6.522 |
| logSw: | -5.8991 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.281 |
| InChI Key: | JMRPUDYJFCIUCJ-MHZLTWQESA-N |