ethyl 6-tert-butyl-2-[(3,4-dichlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 6-tert-butyl-2-[(3,4-dichlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 6-tert-butyl-2-[(3,4-dichlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y508-2892 |
| Compound Name: | ethyl 6-tert-butyl-2-[(3,4-dichlorophenyl)carbamamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 469.43 |
| Molecular Formula: | C22 H26 Cl2 N2 O3 S |
| Smiles: | CCOC(c1c2CCC(Cc2sc1NC(Nc1ccc(c(c1)[Cl])[Cl])=O)C(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.7314 |
| logD: | 5.5741 |
| logSw: | -6.8153 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.01 |
| InChI Key: | PHPCMPFHEMTKAP-GFCCVEGCSA-N |