(2-chlorophenyl)(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(2-chlorophenyl)(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)methanone
(2-chlorophenyl)(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V011-0407 |
| Compound Name: | (2-chlorophenyl)(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 555.05 |
| Molecular Formula: | C31 H28 Cl F N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(Cc2nc(c3c(C)nn(c4ccc(cc4)F)c3n2)N2CCN(CC2)C(c2ccccc2[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.0247 |
| logD: | 5.9229 |
| logSw: | -5.9386 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.15 |
| InChI Key: | FFBFTFIMTPLWCH-UHFFFAOYSA-N |