4-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-ethyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
4-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-ethyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine
4-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-ethyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V028-0482 |
| Compound Name: | 4-[4-(4-chlorobenzene-1-sulfonyl)piperazin-1-yl]-6-ethyl-1-(4-fluorophenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 515.01 |
| Molecular Formula: | C24 H24 Cl F N6 O2 S |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccc(cc3)F)c2n1)N1CCN(CC1)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9639 |
| logD: | 4.5885 |
| logSw: | -5.044 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.484 |
| InChI Key: | HUMJRLAFVJCGPQ-UHFFFAOYSA-N |