4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D074-0306 |
| Compound Name: | 4-(3-chlorophenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 489.96 |
| Molecular Formula: | C27 H24 Cl N3 O4 |
| Smiles: | COc1ccc(CCN2C(c3cccc(c3)[Cl])c3c(c4ccccc4O)n[nH]c3C2=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5811 |
| logD: | 5.5696 |
| logSw: | -5.5406 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.926 |
| InChI Key: | XEXGKXHHRGSNTL-AREMUKBSSA-N |