5-ethoxy-2-[(heptylamino)methylidene]-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
5-ethoxy-2-[(heptylamino)methylidene]-1-benzothiophen-3(2H)-one
5-ethoxy-2-[(heptylamino)methylidene]-1-benzothiophen-3(2H)-one
Compound characteristics
Compound ID: | 8008-4988 |
Compound Name: | 5-ethoxy-2-[(heptylamino)methylidene]-1-benzothiophen-3(2H)-one |
Molecular Weight: | 319.46 |
Molecular Formula: | C18 H25 N O2 S |
Smiles: | CCCCCCCN\C=C1/C(c2cc(ccc2S1)OCC)=O |
Stereo: | ACHIRAL |
logP: | 5.0115 |
logD: | 5.0108 |
logSw: | -4.5961 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 33.769 |
InChI Key: | BQDLXCHJJOQCDY-UHFFFAOYSA-N |