methyl 4,5-dimethyl-2-{2-[(pentafluorophenyl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4,5-dimethyl-2-{2-[(pentafluorophenyl)sulfanyl]acetamido}thiophene-3-carboxylate
methyl 4,5-dimethyl-2-{2-[(pentafluorophenyl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y500-7875 |
| Compound Name: | methyl 4,5-dimethyl-2-{2-[(pentafluorophenyl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 425.39 |
| Molecular Formula: | C16 H12 F5 N O3 S2 |
| Smiles: | Cc1c(C(=O)OC)c(NC(CSc2c(c(c(c(c2F)F)F)F)F)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.1736 |
| logD: | 1.9507 |
| logSw: | -4.2984 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.084 |
| InChI Key: | RWKAOFKBCWODED-UHFFFAOYSA-N |