ethyl 4-{4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-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-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
ethyl 4-{4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate
Compound characteristics
| Compound ID: | V007-8678 |
| Compound Name: | ethyl 4-{4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-4-oxobutanoate |
| Molecular Weight: | 510.61 |
| Molecular Formula: | C27 H35 F N6 O3 |
| Salt: | not_available |
| Smiles: | CCCC(C)c1nc(c2c(C)nn(c3ccc(cc3)F)c2n1)N1CCN(CC1)C(CCC(=O)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5155 |
| logD: | 3.8946 |
| logSw: | -4.4558 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.334 |
| InChI Key: | LQTDLTZFYAQPJX-SFHVURJKSA-N |