1-(3,4-dimethylphenyl)-3-methyl-4-(thiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3,4-dimethylphenyl)-3-methyl-4-(thiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3,4-dimethylphenyl)-3-methyl-4-(thiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1079 |
| Compound Name: | 1-(3,4-dimethylphenyl)-3-methyl-4-(thiophene-2-carbonyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 365.45 |
| Molecular Formula: | C20 H19 N3 O2 S |
| Smiles: | Cc1ccc(cc1C)n1c2c(C(CC(N2)=O)C(c2cccs2)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7384 |
| logD: | 3.6681 |
| logSw: | -3.9136 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.848 |
| InChI Key: | OSMOJAUOLPBKIV-OAHLLOKOSA-N |