6-benzyl-3-methyl-4-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-3-methyl-4-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-3-methyl-4-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V001-9977 |
| Compound Name: | 6-benzyl-3-methyl-4-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 538.67 |
| Molecular Formula: | C30 H30 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)c1c2c(C)nn(c3ccccc3)c2nc(Cc2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7316 |
| logD: | 5.6298 |
| logSw: | -5.881 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.213 |
| InChI Key: | FAJKNVUBEBMIMV-UHFFFAOYSA-N |