4-(4-butoxy-3-methoxyphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(4-butoxy-3-methoxyphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(4-butoxy-3-methoxyphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D074-0212 |
| Compound Name: | 4-(4-butoxy-3-methoxyphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 493.6 |
| Molecular Formula: | C28 H35 N3 O5 |
| Smiles: | CCCCOc1ccc(cc1OC)C1c2c(c3ccccc3O)n[nH]c2C(N1CCCOC(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4232 |
| logD: | 5.4117 |
| logSw: | -5.09 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.272 |
| InChI Key: | IZJBYAGBXLBNSO-MHZLTWQESA-N |