1-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
Compound ID: | J012-1946 |
Compound Name: | 1-(4-chlorophenyl)-4-(3,4,5-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
Molecular Weight: | 413.86 |
Molecular Formula: | C21 H20 Cl N3 O4 |
Smiles: | COc1cc(cc(c1OC)OC)C1CC(Nc2c1cnn2c1ccc(cc1)[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6313 |
logD: | 3.6313 |
logSw: | -4.0053 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.716 |
InChI Key: | UCDOWZAXTCTKST-HNNXBMFYSA-N |