N-[2-(azepan-1-yl)ethyl]-1-[2-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-1-[2-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
N-[2-(azepan-1-yl)ethyl]-1-[2-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | M560-0176 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-1-[2-(pyrrolidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide |
| Molecular Weight: | 400.57 |
| Molecular Formula: | C22 H36 N6 O |
| Smiles: | C1CCCN(CC1)CCNC(C1CCN(CC1)c1cnc(nc1)N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1664 |
| logD: | 0.3838 |
| logSw: | -2.3648 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.619 |
| InChI Key: | VLXVCFWQQQLUIS-UHFFFAOYSA-N |