1-(azepan-1-yl)-2-(2-oxopyridin-1(2H)-yl)ethenyl benzoate
Chemical Structure Depiction of
1-(azepan-1-yl)-2-(2-oxopyridin-1(2H)-yl)ethenyl benzoate
1-(azepan-1-yl)-2-(2-oxopyridin-1(2H)-yl)ethenyl benzoate
Compound characteristics
| Compound ID: | 8013-6458 |
| Compound Name: | 1-(azepan-1-yl)-2-(2-oxopyridin-1(2H)-yl)ethenyl benzoate |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C20 H22 N2 O3 |
| Smiles: | C1CCCN(CC1)/C(=C/N1C=CC=CC1=O)OC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.635 |
| logD: | 2.6343 |
| logSw: | -2.8532 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.498 |
| InChI Key: | XUDUMWADEDHSLD-UHFFFAOYSA-N |