N-{3-[(propan-2-yl)oxy]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{3-[(propan-2-yl)oxy]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-{3-[(propan-2-yl)oxy]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0452 |
| Compound Name: | N-{3-[(propan-2-yl)oxy]propyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 414.55 |
| Molecular Formula: | C22 H34 N6 O2 |
| Smiles: | CC(C)OCCCNC(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.345 |
| logD: | 2.3393 |
| logSw: | -2.4507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.323 |
| InChI Key: | CNNOAGCNJCGTPL-UHFFFAOYSA-N |