ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-{4-[(propan-2-yl)oxy]phenyl}propanoate
Chemical Structure Depiction of
ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-{4-[(propan-2-yl)oxy]phenyl}propanoate
ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-{4-[(propan-2-yl)oxy]phenyl}propanoate
Compound characteristics
| Compound ID: | C561-2126 |
| Compound Name: | ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-{4-[(propan-2-yl)oxy]phenyl}propanoate |
| Molecular Weight: | 570.73 |
| Molecular Formula: | C34 H42 N4 O4 |
| Smiles: | CCOC(CC(c1ccc(cc1)OC(C)C)NC(CCc1c(C)c2c(C)nn(c3ccc(C)c(C)c3)c2nc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6928 |
| logD: | 6.6805 |
| logSw: | -5.9277 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.003 |
| InChI Key: | VSZHKCDDXXHGEX-PMERELPUSA-N |