3-[6-oxo-2-propyl-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoic acid
Chemical Structure Depiction of
3-[6-oxo-2-propyl-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoic acid
3-[6-oxo-2-propyl-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoic acid
Compound characteristics
| Compound ID: | Y507-0654 |
| Compound Name: | 3-[6-oxo-2-propyl-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoic acid |
| Molecular Weight: | 317.27 |
| Molecular Formula: | C13 H14 F3 N3 O3 |
| Smiles: | CCCn1cc2C(=CC(N(CCC(O)=O)c2n1)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 0.7868 |
| logD: | -1.7329 |
| logSw: | -1.2748 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.067 |
| InChI Key: | AGSMIGGVYYGSRK-UHFFFAOYSA-N |