3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propan-1-one
Chemical Structure Depiction of
3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propan-1-one
3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propan-1-one
Compound characteristics
| Compound ID: | C561-2112 |
| Compound Name: | 3-[1-(3,4-dimethylphenyl)-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl]-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]propan-1-one |
| Molecular Weight: | 509.7 |
| Molecular Formula: | C32 H39 N5 O |
| Smiles: | CC1CN(CCN1c1cccc(C)c1)C(CCc1c(C)c2c(C)nn(c3ccc(C)c(C)c3)c2nc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5013 |
| logD: | 6.4889 |
| logSw: | -5.933 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.811 |
| InChI Key: | KMRBWIKGBFSNEV-QHCPKHFHSA-N |