3-(2-hydroxy-4,6-dimethylphenyl)-5-(2-hydroxyethyl)-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
3-(2-hydroxy-4,6-dimethylphenyl)-5-(2-hydroxyethyl)-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
3-(2-hydroxy-4,6-dimethylphenyl)-5-(2-hydroxyethyl)-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D158-0361 |
| Compound Name: | 3-(2-hydroxy-4,6-dimethylphenyl)-5-(2-hydroxyethyl)-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C24 H25 N3 O4 |
| Smiles: | Cc1cc(C)c(c(c1)O)c1c2C(c3ccc(cc3)OCC=C)N(CCO)C(c2[nH]n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0146 |
| logD: | 4.0104 |
| logSw: | -3.8547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.01 |
| InChI Key: | DABGCUASXPNJJT-QHCPKHFHSA-N |