N-[4-(propan-2-yl)phenyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[4-(propan-2-yl)phenyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-[4-(propan-2-yl)phenyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0052 |
| Compound Name: | N-[4-(propan-2-yl)phenyl]-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 432.57 |
| Molecular Formula: | C25 H32 N6 O |
| Smiles: | CC(C)c1ccc(cc1)NC(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4331 |
| logD: | 4.4273 |
| logSw: | -4.1881 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.62 |
| InChI Key: | ZARYPFKXNGAJQS-IBGZPJMESA-N |