N-(2-{cyclopentyl[(furan-2-yl)methyl]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-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0174 |
| Compound Name: | N-(2-{cyclopentyl[(furan-2-yl)methyl]amino}ethyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 505.66 |
| Molecular Formula: | C28 H39 N7 O2 |
| Smiles: | C1CCc2nc3c(ncnc3n2CC1)N1CCCC(C1)C(NCCN(Cc1ccco1)C1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3169 |
| logD: | 2.7069 |
| logSw: | -3.2984 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.725 |
| InChI Key: | XIIJPUBSOXHNAP-NRFANRHFSA-N |