N-({5-[(azepan-1-yl)methyl]furan-2-yl}methyl)-3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Chemical Structure Depiction of
N-({5-[(azepan-1-yl)methyl]furan-2-yl}methyl)-3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
N-({5-[(azepan-1-yl)methyl]furan-2-yl}methyl)-3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | C561-3083 |
| Compound Name: | N-({5-[(azepan-1-yl)methyl]furan-2-yl}methyl)-3,6-dimethyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-b]pyridine-4-carboxamide |
| Molecular Weight: | 471.6 |
| Molecular Formula: | C28 H33 N5 O2 |
| Smiles: | Cc1ccc(cc1)n1c2c(c(cc(C)n2)C(NCc2ccc(CN3CCCCCC3)o2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2048 |
| logD: | 3.137 |
| logSw: | -5.0328 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.929 |
| InChI Key: | VCVHEEWDSUVPDC-UHFFFAOYSA-N |