ethyl 4-(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)-4-oxobutanoate
ethyl 4-(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)-4-oxobutanoate
Compound characteristics
| Compound ID: | V014-1675 |
| Compound Name: | ethyl 4-(4-{1-(4-fluorophenyl)-3-methyl-6-[(4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl}piperazin-1-yl)-4-oxobutanoate |
| Molecular Weight: | 544.63 |
| Molecular Formula: | C30 H33 F N6 O3 |
| Salt: | not_available |
| Smiles: | CCOC(CCC(N1CCN(CC1)c1c2c(C)nn(c3ccc(cc3)F)c2nc(Cc2ccc(C)cc2)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6095 |
| logD: | 4.5077 |
| logSw: | -4.6049 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.053 |
| InChI Key: | DHOGJPOFFANLPZ-UHFFFAOYSA-N |