propan-2-yl 2-{4-[(2-chlorophenoxy)methyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
propan-2-yl 2-{4-[(2-chlorophenoxy)methyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
propan-2-yl 2-{4-[(2-chlorophenoxy)methyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6228-1644 |
| Compound Name: | propan-2-yl 2-{4-[(2-chlorophenoxy)methyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 484.01 |
| Molecular Formula: | C26 H26 Cl N O4 S |
| Smiles: | CC(C)OC(c1c2CCCCc2sc1NC(c1ccc(COc2ccccc2[Cl])cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4587 |
| logD: | 2.7235 |
| logSw: | -6.2332 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.792 |
| InChI Key: | ZJGNYJOYLCADPR-UHFFFAOYSA-N |