1-(azepan-1-yl)-3-(5-{5-[2-(4-methoxyphenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-3-(5-{5-[2-(4-methoxyphenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one
1-(azepan-1-yl)-3-(5-{5-[2-(4-methoxyphenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0750 |
| Compound Name: | 1-(azepan-1-yl)-3-(5-{5-[2-(4-methoxyphenyl)ethenyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)propan-1-one |
| Molecular Weight: | 472.55 |
| Molecular Formula: | C26 H28 N6 O3 |
| Smiles: | COc1ccc(/C=C/c2nc(c3ccc4c(c3)nnn4CCC(N3CCCCCC3)=O)no2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6987 |
| logD: | 4.6987 |
| logSw: | -4.4481 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.982 |
| InChI Key: | UHFCGPISABYTJH-UHFFFAOYSA-N |