5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[2-(thiophen-2-yl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[2-(thiophen-2-yl)ethenyl]-1,3-oxazole-4-carbonitrile
5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[2-(thiophen-2-yl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D151-0872 |
| Compound Name: | 5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[2-(thiophen-2-yl)ethenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C20 H19 N3 O3 S |
| Smiles: | COc1ccc(CCNc2c(C#N)nc(/C=C/c3cccs3)o2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.1488 |
| logD: | 3.1488 |
| logSw: | -3.2849 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.064 |
| InChI Key: | HZIGMFFZVPMARK-UHFFFAOYSA-N |