5-(5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
5-(5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F838-0537 |
| Compound Name: | 5-(5-{[(3-methylphenyl)methanesulfonyl]methyl}furan-2-yl)-3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazole |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C22 H20 N2 O4 S2 |
| Smiles: | Cc1cccc(CS(Cc2ccc(c3nc(c4ccc(cc4)SC)no3)o2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7355 |
| logD: | 5.7355 |
| logSw: | -5.5956 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.514 |
| InChI Key: | SEOPTOHOKDPSFC-UHFFFAOYSA-N |