4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V012-6810 |
| Compound Name: | 4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 518.68 |
| Molecular Formula: | C28 H34 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCCC(C)c1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)S(c1ccc(C)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4909 |
| logD: | 6.3793 |
| logSw: | -5.7337 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.472 |
| InChI Key: | JLIJFRLTABMJGD-QFIPXVFZSA-N |