4-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazole-4-sulfonyl)-2-(2-methylpropyl)-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazole-4-sulfonyl)-2-(2-methylpropyl)-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazole-4-sulfonyl)-2-(2-methylpropyl)-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | Y505-3013 |
| Compound Name: | 4-(difluoromethyl)-7-(1,3-dimethyl-1H-pyrazole-4-sulfonyl)-2-(2-methylpropyl)-2,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 399.42 |
| Molecular Formula: | C16 H19 F2 N5 O3 S |
| Smiles: | CC(C)Cn1cc2C(=CC(N(c2n1)S(c1cn(C)nc1C)(=O)=O)=O)C(F)F |
| Stereo: | ACHIRAL |
| logP: | 0.9714 |
| logD: | 0.9714 |
| logSw: | -1.8736 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.818 |
| InChI Key: | XXXTZYNMYNBBTM-UHFFFAOYSA-N |