5-(benzylamino)-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-(benzylamino)-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-(benzylamino)-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
Compound ID: | D151-0437 |
Compound Name: | 5-(benzylamino)-2-[2-(3,4-dimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
Molecular Weight: | 361.4 |
Molecular Formula: | C21 H19 N3 O3 |
Smiles: | COc1ccc(/C=C/c2nc(C#N)c(NCc3ccccc3)o2)cc1OC |
Stereo: | ACHIRAL |
logP: | 3.7094 |
logD: | 3.7094 |
logSw: | -4.0681 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 61.204 |
InChI Key: | IXCULGPLIHNQRZ-UHFFFAOYSA-N |