N-[3-(4-phenylpiperazin-1-yl)propyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-phenylpiperazin-1-yl)propyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-[3-(4-phenylpiperazin-1-yl)propyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0180 |
| Compound Name: | N-[3-(4-phenylpiperazin-1-yl)propyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 516.69 |
| Molecular Formula: | C29 H40 N8 O |
| Smiles: | C1CCc2nc3c(ncnc3n2CC1)N1CCCC(C1)C(NCCCN1CCN(CC1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9498 |
| logD: | 2.3637 |
| logSw: | -3.0626 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.027 |
| InChI Key: | QMWUQAFVTZHHLF-QHCPKHFHSA-N |