N-[1-(adamantan-1-yl)ethyl]-1-(3-chloro-2-methylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-1-(3-chloro-2-methylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
N-[1-(adamantan-1-yl)ethyl]-1-(3-chloro-2-methylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | E981-1053 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-1-(3-chloro-2-methylphenyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carboxamide |
| Molecular Weight: | 477.05 |
| Molecular Formula: | C28 H33 Cl N4 O |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(c1cc(C)nc2c1c(C)nn2c1cccc(c1C)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4458 |
| logD: | 6.4457 |
| logSw: | -6.2082 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.75 |
| InChI Key: | PMNHLQYRFHBCBT-CBKZDSQWSA-N |