(2,6-dimethoxyphenyl)(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
(2,6-dimethoxyphenyl)(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)methanone
(2,6-dimethoxyphenyl)(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: | V016-9027 |
| Compound Name: | (2,6-dimethoxyphenyl)(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 580.66 |
| Molecular Formula: | C33 H33 F N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(Cc2nc(c3c(C)nn(c4ccc(cc4)F)c3n2)N2CCN(CC2)C(c2c(cccc2OC)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1738 |
| logD: | 5.0721 |
| logSw: | -5.3505 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.411 |
| InChI Key: | NZMFZMVHJJIREW-UHFFFAOYSA-N |