N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide
Compound characteristics
Compound ID: | C999-0192 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]propanamide |
Molecular Weight: | 470.57 |
Molecular Formula: | C28 H30 N4 O3 |
Smiles: | Cc1ccc(cc1C)n1c2c(c(C)c(CCC(Nc3ccc4c(c3)OCCO4)=O)c(C)n2)c(C)n1 |
Stereo: | ACHIRAL |
logP: | 4.6342 |
logD: | 4.6217 |
logSw: | -4.709 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.912 |
InChI Key: | RARUGOQQRKDDQN-UHFFFAOYSA-N |