(4-butylphenyl){4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(4-butylphenyl){4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone
(4-butylphenyl){4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V030-5119 |
| Compound Name: | (4-butylphenyl){4-[1-(4-fluorophenyl)-3-methyl-6-(pentan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 542.7 |
| Molecular Formula: | C32 H39 F N6 O |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)C(N1CCN(CC1)c1c2c(C)nn(c3ccc(cc3)F)c2nc(C(C)CCC)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.486 |
| logD: | 6.8651 |
| logSw: | -5.9918 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.431 |
| InChI Key: | PMGVLWURZKKKEN-QFIPXVFZSA-N |