methyl 3-ethoxy-5-(2-phenylbutanamido)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-ethoxy-5-(2-phenylbutanamido)-1-benzothiophene-2-carboxylate
methyl 3-ethoxy-5-(2-phenylbutanamido)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | L312-0030 |
| Compound Name: | methyl 3-ethoxy-5-(2-phenylbutanamido)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 397.49 |
| Molecular Formula: | C22 H23 N O4 S |
| Smiles: | CCC(C(Nc1ccc2c(c1)c(c(C(=O)OC)s2)OCC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2341 |
| logD: | 5.234 |
| logSw: | -5.1833 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.547 |
| InChI Key: | JBGQDXPLLZDBDX-MRXNPFEDSA-N |