5-(azepan-1-yl)-2-[2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(azepan-1-yl)-2-[2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-(azepan-1-yl)-2-[2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
Compound ID: | D151-0255 |
Compound Name: | 5-(azepan-1-yl)-2-[2-(4-fluorophenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
Molecular Weight: | 311.36 |
Molecular Formula: | C18 H18 F N3 O |
Smiles: | C1CCCN(CC1)c1c(C#N)nc(/C=C/c2ccc(cc2)F)o1 |
Stereo: | ACHIRAL |
logP: | 4.5198 |
logD: | 4.5198 |
logSw: | -4.3303 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 39.751 |
InChI Key: | KXUIXACAHHVACW-UHFFFAOYSA-N |