3-(2H-1,3-benzodioxol-5-yl)-5-[5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-yl]-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-[5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-yl]-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-[5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-yl]-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | F837-0517 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-[5-({[(4-methylphenyl)methyl]sulfanyl}methyl)furan-2-yl]-1,2,4-oxadiazole |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C22 H18 N2 O4 S |
| Smiles: | Cc1ccc(CSCc2ccc(c3nc(c4ccc5c(c4)OCO5)no3)o2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 6.1374 |
| logD: | 6.1374 |
| logSw: | -5.6104 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.329 |
| InChI Key: | MMTYGJTZAODSIJ-UHFFFAOYSA-N |