ethyl 2-(3,4-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(3,4-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(3,4-difluorobenzamido)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V012-4342 |
| Compound Name: | ethyl 2-(3,4-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(c3ccc(c(c3)F)F)=O)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4954 |
| logD: | 0.0226 |
| logSw: | -5.6006 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.798 |
| InChI Key: | XHOWHJIDOHFMSL-LLVKDONJSA-N |