N-ethyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-ethyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-ethyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0642 |
| Compound Name: | N-ethyl-N-(2-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 432.57 |
| Molecular Formula: | C25 H32 N6 O |
| Smiles: | CCN(C(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O)c1ccccc1C |
| Stereo: | ACHIRAL |
| logP: | 4.3764 |
| logD: | 4.3706 |
| logSw: | -4.2319 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.642 |
| InChI Key: | XUFCSQZMJANUGT-UHFFFAOYSA-N |