ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-(4-methylphenyl)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-methylphenyl)propanoate
ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-(4-methylphenyl)propanoate
Compound characteristics
| Compound ID: | C561-2127 |
| Compound Name: | ethyl 3-{3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}-3-(4-methylphenyl)propanoate |
| Molecular Weight: | 526.68 |
| Molecular Formula: | C32 H38 N4 O3 |
| Smiles: | CCOC(CC(c1ccc(C)cc1)NC(CCc1c(C)c2c(C)nn(c3ccc(C)c(C)c3)c2nc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4497 |
| logD: | 6.4373 |
| logSw: | -5.9064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.2 |
| InChI Key: | BDLMVGOABMNWHX-NDEPHWFRSA-N |