6-butyl-3-methyl-1-phenyl-4-[4-(2-phenylethenesulfonyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-butyl-3-methyl-1-phenyl-4-[4-(2-phenylethenesulfonyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
6-butyl-3-methyl-1-phenyl-4-[4-(2-phenylethenesulfonyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V004-0043 |
| Compound Name: | 6-butyl-3-methyl-1-phenyl-4-[4-(2-phenylethenesulfonyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 516.67 |
| Molecular Formula: | C28 H32 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCCCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCN(CC1)S(/C=C/c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.415 |
| logD: | 4.8692 |
| logSw: | -5.4771 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.379 |
| InChI Key: | ZZPJHWFADDUHAS-UHFFFAOYSA-N |