6-benzyl-3-methyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-3-methyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-3-methyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V019-4639 |
| Compound Name: | 6-benzyl-3-methyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 552.7 |
| Molecular Formula: | C31 H32 N6 O2 S |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(Cc3ccccc3)nc2n(c2ccccc2)n1)N1CCCN(CC1)S(Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1327 |
| logD: | 5.031 |
| logSw: | -5.2369 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.438 |
| InChI Key: | RYPLVSZCUPYHGG-UHFFFAOYSA-N |