4-(4-tert-butylphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Chemical Structure Depiction of
4-(4-tert-butylphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
4-(4-tert-butylphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one
Compound characteristics
| Compound ID: | D074-0200 |
| Compound Name: | 4-(4-tert-butylphenyl)-3-(2-hydroxyphenyl)-5-{3-[(propan-2-yl)oxy]propyl}-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | CC(C)OCCCN1C(c2ccc(cc2)C(C)(C)C)c2c(c3ccccc3O)n[nH]c2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.06 |
| logD: | 6.0485 |
| logSw: | -5.2223 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.138 |
| InChI Key: | IWMYWKLDQZIAKA-VWLOTQADSA-N |