6-benzyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V011-9849 |
| Compound Name: | 6-benzyl-1-phenyl-4-[4-(phenylmethanesulfonyl)-1,4-diazepan-1-yl]-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 538.67 |
| Molecular Formula: | C30 H30 N6 O2 S |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)S(Cc1ccccc1)(=O)=O)c1c2cnn(c3ccccc3)c2nc(Cc2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3375 |
| logD: | 5.327 |
| logSw: | -5.5514 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.085 |
| InChI Key: | DDJJCDMODHLTEX-UHFFFAOYSA-N |