N-(3-chlorophenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
N-(3-chlorophenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E715-0631 |
| Compound Name: | N-(3-chlorophenyl)-N-methyl-1-(7,8,9,10-tetrahydro-6H-azepino[1,2-e]purin-4-yl)piperidine-4-carboxamide |
| Molecular Weight: | 438.96 |
| Molecular Formula: | C23 H27 Cl N6 O |
| Smiles: | CN(C(C1CCN(CC1)c1c2c(ncn1)n1CCCCCc1n2)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9973 |
| logD: | 3.9915 |
| logSw: | -4.3602 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.965 |
| InChI Key: | ORJWMGJNJUNNRK-UHFFFAOYSA-N |