2-chloro-1-(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-chloro-1-(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one
2-chloro-1-(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V030-4312 |
| Compound Name: | 2-chloro-1-(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)ethan-1-one |
| Molecular Weight: | 474.99 |
| Molecular Formula: | C26 H27 Cl N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(Cc2nc(c3c(C)nn(c4ccccc4)c3n2)N2CCN(CC2)C(C[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2933 |
| logD: | 4.1915 |
| logSw: | -4.4529 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.894 |
| InChI Key: | LQIKQJSAMNGIKG-UHFFFAOYSA-N |