4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V024-7619 |
| Compound Name: | 4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 490.63 |
| Molecular Formula: | C26 H30 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccccc3C)c2n1)N1CCCN(CC1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.765 |
| logD: | 4.0735 |
| logSw: | -4.7366 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.515 |
| InChI Key: | VDEFTADSPXBICQ-UHFFFAOYSA-N |