4-(4-butoxy-3-ethoxyphenyl)-3-(2-hydroxyphenyl)-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(4-butoxy-3-ethoxyphenyl)-3-(2-hydroxyphenyl)-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(4-butoxy-3-ethoxyphenyl)-3-(2-hydroxyphenyl)-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D074-0040 |
| Compound Name: | 4-(4-butoxy-3-ethoxyphenyl)-3-(2-hydroxyphenyl)-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 491.59 |
| Molecular Formula: | C28 H33 N3 O5 |
| Smiles: | CCCCOc1ccc(cc1OCC)C1c2c(c3ccccc3O)n[nH]c2C(N1CC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0519 |
| logD: | 5.0404 |
| logSw: | -4.1753 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.056 |
| InChI Key: | GHXHKYNJEXWYNF-UHFFFAOYSA-N |