4-(3-ethoxy-4-hydroxyphenyl)-3-(2-hydroxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(3-ethoxy-4-hydroxyphenyl)-3-(2-hydroxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(3-ethoxy-4-hydroxyphenyl)-3-(2-hydroxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
Compound ID: | D074-0282 |
Compound Name: | 4-(3-ethoxy-4-hydroxyphenyl)-3-(2-hydroxyphenyl)-5-[2-(4-methoxyphenyl)ethyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
Molecular Weight: | 485.54 |
Molecular Formula: | C28 H27 N3 O5 |
Smiles: | CCOc1cc(ccc1O)C1c2c(c3ccccc3O)n[nH]c2C(N1CCc1ccc(cc1)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.2081 |
logD: | 5.1965 |
logSw: | -4.7183 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 87.967 |
InChI Key: | BRMNJPLZKBCFLB-MHZLTWQESA-N |