4-(2,3-dimethoxyphenyl)-1-(4-fluorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(2,3-dimethoxyphenyl)-1-(4-fluorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(2,3-dimethoxyphenyl)-1-(4-fluorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J012-2680 |
| Compound Name: | 4-(2,3-dimethoxyphenyl)-1-(4-fluorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 367.38 |
| Molecular Formula: | C20 H18 F N3 O3 |
| Smiles: | COc1cccc(C2CC(Nc3c2cnn3c2ccc(cc2)F)=O)c1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2069 |
| logD: | 3.2069 |
| logSw: | -3.2516 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.086 |
| InChI Key: | ROFUYOAQCSEUBY-HNNXBMFYSA-N |