N-[(4-fluorophenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine
N-[(4-fluorophenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine
Compound characteristics
| Compound ID: | E679-0642 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-amine |
| Molecular Weight: | 311.36 |
| Molecular Formula: | C17 H18 F N5 |
| Smiles: | C1CCc2nc3c(NCc4ccc(cc4)F)ncnc3n2CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.8487 |
| logD: | 2.8468 |
| logSw: | -3.0438 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.084 |
| InChI Key: | PPAWIVIAHPKGNN-UHFFFAOYSA-N |