5-ethoxy-2-({[(4-fluorophenyl)methyl]amino}methylidene)-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
5-ethoxy-2-({[(4-fluorophenyl)methyl]amino}methylidene)-1-benzothiophen-3(2H)-one
5-ethoxy-2-({[(4-fluorophenyl)methyl]amino}methylidene)-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 2104-0093 |
| Compound Name: | 5-ethoxy-2-({[(4-fluorophenyl)methyl]amino}methylidene)-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 329.39 |
| Molecular Formula: | C18 H16 F N O2 S |
| Smiles: | CCOc1ccc2c(c1)C(/C(=C\NCc1ccc(cc1)F)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4945 |
| logD: | 3.4945 |
| logSw: | -3.7621 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.656 |
| InChI Key: | FMAFWNCWBDBFEU-UHFFFAOYSA-N |