4-(3-ethoxy-4-hydroxyphenyl)-5-(3-ethoxypropyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(3-ethoxy-4-hydroxyphenyl)-5-(3-ethoxypropyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(3-ethoxy-4-hydroxyphenyl)-5-(3-ethoxypropyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
Compound ID: | D174-0661 |
Compound Name: | 4-(3-ethoxy-4-hydroxyphenyl)-5-(3-ethoxypropyl)-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
Molecular Weight: | 437.49 |
Molecular Formula: | C24 H27 N3 O5 |
Smiles: | CCOCCCN1C(c2ccc(c(c2)OCC)O)c2c(c3ccccc3O)n[nH]c2C1=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8598 |
logD: | 3.8483 |
logSw: | -3.3165 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 88.672 |
InChI Key: | LNTXPLMFUYWRMB-QHCPKHFHSA-N |