6-benzyl-4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V018-9783 |
| Compound Name: | 6-benzyl-4-[4-(4-methylbenzene-1-sulfonyl)-1,4-diazepan-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(N1CCCN(CC1)c1c2cnn(c3ccccc3)c2nc(Cc2ccccc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1615 |
| logD: | 6.151 |
| logSw: | -5.5063 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.191 |
| InChI Key: | RVQCXMSHIFDEOU-UHFFFAOYSA-N |