ethyl 2-acetamido-7-chloro-6-cyano-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-acetamido-7-chloro-6-cyano-1-benzothiophene-3-carboxylate
ethyl 2-acetamido-7-chloro-6-cyano-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | F235-0663 |
| Compound Name: | ethyl 2-acetamido-7-chloro-6-cyano-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 322.77 |
| Molecular Formula: | C14 H11 Cl N2 O3 S |
| Smiles: | CCOC(c1c2ccc(C#N)c(c2sc1NC(C)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.0794 |
| logD: | 1.8661 |
| logSw: | -4.0588 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.833 |
| InChI Key: | XDZONNKAJADQGL-UHFFFAOYSA-N |