ethyl 2-(3,5-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3,5-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3,5-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
Compound ID: | V012-2791 |
Compound Name: | ethyl 2-(3,5-dichlorobenzamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
Molecular Weight: | 398.31 |
Molecular Formula: | C18 H17 Cl2 N O3 S |
Smiles: | CCOC(c1c2CCCCc2sc1NC(c1cc(cc(c1)[Cl])[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.6234 |
logD: | 0.1917 |
logSw: | -6.1389 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 43.798 |
InChI Key: | FCONUECYOAQZRJ-UHFFFAOYSA-N |