N-[1-(adamantan-1-yl)propan-2-yl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)propan-2-yl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-[1-(adamantan-1-yl)propan-2-yl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0573 |
| Compound Name: | N-[1-(adamantan-1-yl)propan-2-yl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 490.69 |
| Molecular Formula: | C29 H42 N6 O |
| Smiles: | CC(CC12CC3CC(CC(C3)C2)C1)NC(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3944 |
| logD: | 5.3887 |
| logSw: | -5.1747 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.484 |
| InChI Key: | NQKRNIYOXDEFAN-HFESIUDZSA-N |