N-[2-(azepan-1-yl)pyrimidin-5-yl]-4-cyanobenzamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)pyrimidin-5-yl]-4-cyanobenzamide
N-[2-(azepan-1-yl)pyrimidin-5-yl]-4-cyanobenzamide
Compound characteristics
| Compound ID: | P209-0627 |
| Compound Name: | N-[2-(azepan-1-yl)pyrimidin-5-yl]-4-cyanobenzamide |
| Molecular Weight: | 321.38 |
| Molecular Formula: | C18 H19 N5 O |
| Smiles: | C1CCCN(CC1)c1ncc(cn1)NC(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.006 |
| logD: | 2.9974 |
| logSw: | -3.247 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.711 |
| InChI Key: | NEXYWHJXDSVINA-UHFFFAOYSA-N |