ethyl 4-[4-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylphenyl)-6-oxo-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoate
Chemical Structure Depiction of
ethyl 4-[4-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylphenyl)-6-oxo-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoate
ethyl 4-[4-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylphenyl)-6-oxo-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoate
Compound characteristics
| Compound ID: | C390-0365 |
| Compound Name: | ethyl 4-[4-(3-ethoxy-4-hydroxyphenyl)-3-(4-methylphenyl)-6-oxo-4,6-dihydropyrrolo[3,4-c]pyrazol-5(1H)-yl]benzoate |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C29 H27 N3 O5 |
| Smiles: | CCOC(c1ccc(cc1)N1C(c2ccc(c(c2)OCC)O)c2c(c3ccc(C)cc3)n[nH]c2C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4769 |
| logD: | 5.4713 |
| logSw: | -5.1787 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.039 |
| InChI Key: | PGDXTXYVKRGJSC-MHZLTWQESA-N |