ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-6602 |
| Compound Name: | ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 456.39 |
| Molecular Formula: | C21 H23 Cl2 N O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CCCOc1ccc(cc1[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3275 |
| logD: | 3.0038 |
| logSw: | -6.1164 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.089 |
| InChI Key: | HXTZSAXJVFSQLZ-UHFFFAOYSA-N |