N-(3-acetylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
N-(3-acetylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E715-0135 |
| Compound Name: | N-(3-acetylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-3-carboxamide |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C24 H28 N6 O2 |
| Smiles: | CC(c1cccc(c1)NC(C1CCCN(C1)c1c2c(ncn1)n1CCCCCc1n2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8358 |
| logD: | 2.8293 |
| logSw: | -3.2204 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.447 |
| InChI Key: | XWHGRFHJQJSVKS-SFHVURJKSA-N |