2-(2,4-dimethoxyphenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(2,4-dimethoxyphenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
2-(2,4-dimethoxyphenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 8436-0209 |
| Compound Name: | 2-(2,4-dimethoxyphenyl)-5-{[(4-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole |
| Molecular Weight: | 373.39 |
| Molecular Formula: | C17 H15 N3 O5 S |
| Smiles: | COc1ccc(c(c1)OC)c1nnc(o1)SCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1658 |
| logD: | 3.1658 |
| logSw: | -3.5094 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.62 |
| InChI Key: | XVXXOHATDGUJCN-UHFFFAOYSA-N |