2-[({amino[(1,3-benzoxazol-2-yl)amino]methylidene}amino)methylidene]-N-(2-methoxyphenyl)-3-oxobutanamide
Chemical Structure Depiction of
2-[({amino[(1,3-benzoxazol-2-yl)amino]methylidene}amino)methylidene]-N-(2-methoxyphenyl)-3-oxobutanamide
2-[({amino[(1,3-benzoxazol-2-yl)amino]methylidene}amino)methylidene]-N-(2-methoxyphenyl)-3-oxobutanamide
Compound characteristics
| Compound ID: | Y021-1776 |
| Compound Name: | 2-[({amino[(1,3-benzoxazol-2-yl)amino]methylidene}amino)methylidene]-N-(2-methoxyphenyl)-3-oxobutanamide |
| Molecular Weight: | 393.4 |
| Molecular Formula: | C20 H19 N5 O4 |
| Smiles: | CC(\C(=C/N=C(\N)Nc1nc2ccccc2o1)C(Nc1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9868 |
| logD: | -0.2297 |
| logSw: | -2.4943 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 102.319 |
| InChI Key: | ZLHTYRLNBAEKHE-UHFFFAOYSA-N |