N-benzyl-N-(propan-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-benzyl-N-(propan-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-benzyl-N-(propan-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0332 |
| Compound Name: | N-benzyl-N-(propan-2-yl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 446.6 |
| Molecular Formula: | C26 H34 N6 O |
| Smiles: | CC(C)N(Cc1ccccc1)C(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0005 |
| logD: | 3.9947 |
| logSw: | -4.1105 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.484 |
| InChI Key: | IOCPCOAQYONVRR-NRFANRHFSA-N |