methyl 3-[2-(2-methylpropyl)-6-oxo-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoate
Chemical Structure Depiction of
methyl 3-[2-(2-methylpropyl)-6-oxo-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoate
methyl 3-[2-(2-methylpropyl)-6-oxo-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoate
Compound characteristics
| Compound ID: | Y507-3667 |
| Compound Name: | methyl 3-[2-(2-methylpropyl)-6-oxo-4-(trifluoromethyl)-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]propanoate |
| Molecular Weight: | 345.32 |
| Molecular Formula: | C15 H18 F3 N3 O3 |
| Smiles: | CC(C)Cn1cc2C(=CC(N(CCC(=O)OC)c2n1)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 2.2556 |
| logD: | 2.2556 |
| logSw: | -2.1851 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.284 |
| InChI Key: | XRLCONXBOZGAFY-UHFFFAOYSA-N |