N-{2-[benzyl(ethyl)amino]ethyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{2-[benzyl(ethyl)amino]ethyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-{2-[benzyl(ethyl)amino]ethyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0227 |
| Compound Name: | N-{2-[benzyl(ethyl)amino]ethyl}-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 475.64 |
| Molecular Formula: | C27 H37 N7 O |
| Smiles: | CCN(CCNC(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2486 |
| logD: | 2.3977 |
| logSw: | -3.1563 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.47 |
| InChI Key: | GUAHHQNSNMRCLZ-QFIPXVFZSA-N |