6-benzyl-4-[4-(3-methylbutyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-4-[4-(3-methylbutyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-4-[4-(3-methylbutyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V011-1181 |
| Compound Name: | 6-benzyl-4-[4-(3-methylbutyl)-1,4-diazepan-1-yl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 454.62 |
| Molecular Formula: | C28 H34 N6 |
| Salt: | not_available |
| Smiles: | CC(C)CCN1CCCN(CC1)c1c2cnn(c3ccccc3)c2nc(Cc2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 6.206 |
| logD: | 5.1855 |
| logSw: | -5.7273 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.462 |
| InChI Key: | CERHOCJGDJWFLJ-UHFFFAOYSA-N |