3-[4-(difluoromethyl)-2-methyl-6-oxo-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]-N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}propanamide
Chemical Structure Depiction of
3-[4-(difluoromethyl)-2-methyl-6-oxo-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]-N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}propanamide
3-[4-(difluoromethyl)-2-methyl-6-oxo-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]-N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}propanamide
Compound characteristics
| Compound ID: | Y505-2945 |
| Compound Name: | 3-[4-(difluoromethyl)-2-methyl-6-oxo-2,6-dihydro-7H-pyrazolo[3,4-b]pyridin-7-yl]-N-{1-[(4-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl}propanamide |
| Molecular Weight: | 445.4 |
| Molecular Formula: | C20 H18 F3 N7 O2 |
| Smiles: | Cn1cc2C(=CC(N(CCC(Nc3ncn(Cc4ccc(cc4)F)n3)=O)c2n1)=O)C(F)F |
| Stereo: | ACHIRAL |
| logP: | 1.2836 |
| logD: | 1.2634 |
| logSw: | -2.3766 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.837 |
| InChI Key: | ODRMNRGFZBHIFN-UHFFFAOYSA-N |