ethyl 2-(2,5-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2,5-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2,5-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
Compound ID: | V010-6766 |
Compound Name: | ethyl 2-(2,5-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
Molecular Weight: | 393.45 |
Molecular Formula: | C20 H21 F2 N O3 S |
Smiles: | CCC1CCc2c(C(=O)OCC)c(NC(c3cc(ccc3F)F)=O)sc2C1 |
Stereo: | RACEMIC MIXTURE |
logP: | 5.4523 |
logD: | -0.0205 |
logSw: | -5.5829 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 43.798 |
InChI Key: | DFJMFSXBMPWNDS-LLVKDONJSA-N |