1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-4-carboxamide
1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0405 |
| Compound Name: | 1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)-N-(3,4,5-trimethoxyphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 480.57 |
| Molecular Formula: | C25 H32 N6 O4 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6304 |
| logD: | 2.6229 |
| logSw: | -3.0958 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.665 |
| InChI Key: | NYRAELOWMJPTGV-UHFFFAOYSA-N |