4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V026-9560 |
| Compound Name: | 4-[4-(benzenesulfonyl)-1,4-diazepan-1-yl]-6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 476.6 |
| Molecular Formula: | C25 H28 N6 O2 S |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2587 |
| logD: | 3.8832 |
| logSw: | -4.3135 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.815 |
| InChI Key: | KWRNFPKCOVTCFH-UHFFFAOYSA-N |