N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-chloro-4-fluorobenzamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-chloro-4-fluorobenzamide
N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-chloro-4-fluorobenzamide
Compound characteristics
| Compound ID: | P209-0632 |
| Compound Name: | N-[2-(azepan-1-yl)pyrimidin-5-yl]-2-chloro-4-fluorobenzamide |
| Molecular Weight: | 348.81 |
| Molecular Formula: | C17 H18 Cl F N4 O |
| Smiles: | C1CCCN(CC1)c1ncc(cn1)NC(c1ccc(cc1[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0184 |
| logD: | 3.964 |
| logSw: | -4.5122 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.655 |
| InChI Key: | FKZKMADGDJFIKD-UHFFFAOYSA-N |