3-(2-hydroxyphenyl)-4-[3-(3-methylbutoxy)phenyl]-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
3-(2-hydroxyphenyl)-4-[3-(3-methylbutoxy)phenyl]-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
3-(2-hydroxyphenyl)-4-[3-(3-methylbutoxy)phenyl]-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D074-0036 |
| Compound Name: | 3-(2-hydroxyphenyl)-4-[3-(3-methylbutoxy)phenyl]-5-[(oxolan-2-yl)methyl]-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 461.56 |
| Molecular Formula: | C27 H31 N3 O4 |
| Smiles: | CC(C)CCOc1cccc(c1)C1c2c(c3ccccc3O)n[nH]c2C(N1CC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.4897 |
| logD: | 5.4782 |
| logSw: | -5.0979 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.759 |
| InChI Key: | XCWKUJBLTDHZHS-UHFFFAOYSA-N |