ethyl 2-{4-[(trifluoromethyl)sulfanyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{4-[(trifluoromethyl)sulfanyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{4-[(trifluoromethyl)sulfanyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V011-0341 |
| Compound Name: | ethyl 2-{4-[(trifluoromethyl)sulfanyl]benzamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 429.48 |
| Molecular Formula: | C19 H18 F3 N O3 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(c1ccc(cc1)SC(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9695 |
| logD: | 2.4517 |
| logSw: | -5.6228 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.798 |
| InChI Key: | UMOFNCKXMQRNQS-UHFFFAOYSA-N |