1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0390 |
| Compound Name: | 1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide |
| Molecular Weight: | 458.49 |
| Molecular Formula: | C23 H25 F3 N6 O |
| Smiles: | C1CCc2nc3c(ncnc3n2CC1)N1CCC(CC1)C(Nc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2931 |
| logD: | 4.285 |
| logSw: | -4.2578 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.687 |
| InChI Key: | KFHYYFYSRLIFGI-UHFFFAOYSA-N |