4-(3,4-diethoxyphenyl)-3-(2-hydroxy-5-methylphenyl)-5-[(pyridin-3-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(3,4-diethoxyphenyl)-3-(2-hydroxy-5-methylphenyl)-5-[(pyridin-3-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(3,4-diethoxyphenyl)-3-(2-hydroxy-5-methylphenyl)-5-[(pyridin-3-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D126-0855 |
| Compound Name: | 4-(3,4-diethoxyphenyl)-3-(2-hydroxy-5-methylphenyl)-5-[(pyridin-3-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 484.55 |
| Molecular Formula: | C28 H28 N4 O4 |
| Smiles: | CCOc1ccc(cc1OCC)C1c2c(c3cc(C)ccc3O)n[nH]c2C(N1Cc1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2414 |
| logD: | 4.237 |
| logSw: | -3.5575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.625 |
| InChI Key: | ADEJAQBPZYUDSQ-MHZLTWQESA-N |