methyl (2-fluorophenyl)(4-{4-[(trifluoromethyl)sulfanyl]benzamido}cyclopent-2-en-1-yl)acetate
Chemical Structure Depiction of
methyl (2-fluorophenyl)(4-{4-[(trifluoromethyl)sulfanyl]benzamido}cyclopent-2-en-1-yl)acetate
methyl (2-fluorophenyl)(4-{4-[(trifluoromethyl)sulfanyl]benzamido}cyclopent-2-en-1-yl)acetate
Compound characteristics
| Compound ID: | V006-5840 |
| Compound Name: | methyl (2-fluorophenyl)(4-{4-[(trifluoromethyl)sulfanyl]benzamido}cyclopent-2-en-1-yl)acetate |
| Molecular Weight: | 453.45 |
| Molecular Formula: | C22 H19 F4 N O3 S |
| Smiles: | COC(C(C1CC(C=C1)NC(c1ccc(cc1)SC(F)(F)F)=O)c1ccccc1F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7404 |
| logD: | 5.7404 |
| logSw: | -5.5424 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.645 |
| InChI Key: | DGUFBTXPYDGZJV-UHFFFAOYSA-N |