2-[(butylamino)methylidene]-5-ethoxy-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-[(butylamino)methylidene]-5-ethoxy-1-benzothiophen-3(2H)-one
2-[(butylamino)methylidene]-5-ethoxy-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | Y508-0716 |
| Compound Name: | 2-[(butylamino)methylidene]-5-ethoxy-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 277.38 |
| Molecular Formula: | C15 H19 N O2 S |
| Smiles: | CCCCN\C=C1/C(c2cc(ccc2S1)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5907 |
| logD: | 3.59 |
| logSw: | -3.7862 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.769 |
| InChI Key: | VWIHKZIDWNTGEL-UHFFFAOYSA-N |