1-tert-butyl-4-(3,4-dihydroxy-2,5-dimethoxyphenyl)-5-phenyl-4,4a,5,8-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
Chemical Structure Depiction of
1-tert-butyl-4-(3,4-dihydroxy-2,5-dimethoxyphenyl)-5-phenyl-4,4a,5,8-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
1-tert-butyl-4-(3,4-dihydroxy-2,5-dimethoxyphenyl)-5-phenyl-4,4a,5,8-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one
Compound characteristics
| Compound ID: | 8020-4941 |
| Compound Name: | 1-tert-butyl-4-(3,4-dihydroxy-2,5-dimethoxyphenyl)-5-phenyl-4,4a,5,8-tetrahydroimidazo[4,5-b]pyrazolo[4,3-e]pyridin-6(1H)-one |
| Molecular Weight: | 477.52 |
| Molecular Formula: | C25 H27 N5 O5 |
| Smiles: | CC(C)(C)n1c2c(cn1)C(C1C(N2)=NC(N1c1ccccc1)=O)c1cc(c(c(c1OC)O)O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1532 |
| logD: | 1.8888 |
| logSw: | -3.2808 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 97.095 |
| InChI Key: | SKMIDZSHNSSYCI-UHFFFAOYSA-N |