methyl 2-{3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}benzoate
Chemical Structure Depiction of
methyl 2-{3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}benzoate
methyl 2-{3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}benzoate
Compound characteristics
| Compound ID: | C987-0059 |
| Compound Name: | methyl 2-{3-[3,4,6-trimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamido}benzoate |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C27 H28 N4 O3 |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)c(CCC(Nc3ccccc3C(=O)OC)=O)c(C)n2)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.6821 |
| logD: | 4.6329 |
| logSw: | -4.7589 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.565 |
| InChI Key: | SUVGTKCVPNNBMM-UHFFFAOYSA-N |