2-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
2-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | D353-0436 |
| Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole |
| Molecular Weight: | 392.86 |
| Molecular Formula: | C18 H17 Cl N2 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnc(o1)SCc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9183 |
| logD: | 3.9183 |
| logSw: | -4.3311 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.042 |
| InChI Key: | TVPZTOZDHPVYMK-UHFFFAOYSA-N |