2-[2-(4-ethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[2-(4-ethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
2-[2-(4-ethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D151-0791 |
| Compound Name: | 2-[2-(4-ethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 346.39 |
| Molecular Formula: | C20 H18 N4 O2 |
| Smiles: | CCOc1ccc(/C=C/c2nc(C#N)c(NCc3cccnc3)o2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.1447 |
| logD: | 3.1301 |
| logSw: | -2.8098 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.585 |
| InChI Key: | QPMFSAGQHWBCCS-UHFFFAOYSA-N |