N-(2-methoxy-5-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-(2-methoxy-5-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0434 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 434.54 |
| Molecular Formula: | C24 H30 N6 O2 |
| Smiles: | Cc1ccc(c(c1)NC(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.3854 |
| logD: | 3.3794 |
| logSw: | -3.522 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.619 |
| InChI Key: | RNCXXUMNEINBCM-UHFFFAOYSA-N |