ethyl 2-[2-(2-bromo-4-chlorophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[2-(2-bromo-4-chlorophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[2-(2-bromo-4-chlorophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3772-3955 |
| Compound Name: | ethyl 2-[2-(2-bromo-4-chlorophenoxy)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 472.78 |
| Molecular Formula: | C19 H19 Br Cl N O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(COc1ccc(cc1[Br])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.38 |
| logD: | 3.1981 |
| logSw: | -6.028 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.171 |
| InChI Key: | ZKBIIMRNQJQULY-UHFFFAOYSA-N |