methyl 2-{2-[2-(4-ethylphenyl)-3-oxo-2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[2-(4-ethylphenyl)-3-oxo-2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamido}thiophene-3-carboxylate
methyl 2-{2-[2-(4-ethylphenyl)-3-oxo-2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | G024-1470 |
| Compound Name: | methyl 2-{2-[2-(4-ethylphenyl)-3-oxo-2,3-dihydro-1H-pyrazolo[3,4-b]pyridin-1-yl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 436.49 |
| Molecular Formula: | C22 H20 N4 O4 S |
| Smiles: | CCc1ccc(cc1)N1C(c2cccnc2N1CC(Nc1c(ccs1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4076 |
| logD: | 3.2641 |
| logSw: | -3.672 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.466 |
| InChI Key: | RTNBPJAEGRIYLZ-UHFFFAOYSA-N |