methyl 6-tert-butyl-2-[2-(2,5-dichlorophenoxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 6-tert-butyl-2-[2-(2,5-dichlorophenoxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
methyl 6-tert-butyl-2-[2-(2,5-dichlorophenoxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3112-5144 |
| Compound Name: | methyl 6-tert-butyl-2-[2-(2,5-dichlorophenoxy)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 484.44 |
| Molecular Formula: | C23 H27 Cl2 N O4 S |
| Smiles: | CC(C(Nc1c(C(=O)OC)c2CCC(Cc2s1)C(C)(C)C)=O)Oc1cc(ccc1[Cl])[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.1482 |
| logD: | 4.7154 |
| logSw: | -6.6752 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.094 |
| InChI Key: | WOYIGNSNZKFRFZ-UHFFFAOYSA-N |