methyl 5-{[(2,6-dichlorophenyl)sulfanyl]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[(2,6-dichlorophenyl)sulfanyl]methyl}furan-2-carboxylate
methyl 5-{[(2,6-dichlorophenyl)sulfanyl]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | K780-0687 |
| Compound Name: | methyl 5-{[(2,6-dichlorophenyl)sulfanyl]methyl}furan-2-carboxylate |
| Molecular Weight: | 317.19 |
| Molecular Formula: | C13 H10 Cl2 O3 S |
| Smiles: | COC(c1ccc(CSc2c(cccc2[Cl])[Cl])o1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2948 |
| logD: | 4.2948 |
| logSw: | -4.3081 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 28.9821 |
| InChI Key: | FHPKJKXNKGTYIL-UHFFFAOYSA-N |