5-(3-chlorophenyl)-3-{[4-(methylsulfanyl)phenoxy]methyl}-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(3-chlorophenyl)-3-{[4-(methylsulfanyl)phenoxy]methyl}-1,2,4-oxadiazole
5-(3-chlorophenyl)-3-{[4-(methylsulfanyl)phenoxy]methyl}-1,2,4-oxadiazole
Compound characteristics
Compound ID: | V028-7756 |
Compound Name: | 5-(3-chlorophenyl)-3-{[4-(methylsulfanyl)phenoxy]methyl}-1,2,4-oxadiazole |
Molecular Weight: | 332.81 |
Molecular Formula: | C16 H13 Cl N2 O2 S |
Smiles: | CSc1ccc(cc1)OCc1nc(c2cccc(c2)[Cl])on1 |
Stereo: | ACHIRAL |
logP: | 4.8855 |
logD: | 4.8855 |
logSw: | -4.928 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 40.134 |
InChI Key: | TYXCSIWMDMFLMU-UHFFFAOYSA-N |