2-{[(4-bromophenyl)methyl]sulfanyl}-5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-{[(4-bromophenyl)methyl]sulfanyl}-5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazole
2-{[(4-bromophenyl)methyl]sulfanyl}-5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 8436-0207 |
| Compound Name: | 2-{[(4-bromophenyl)methyl]sulfanyl}-5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazole |
| Molecular Weight: | 407.28 |
| Molecular Formula: | C17 H15 Br N2 O3 S |
| Smiles: | COc1ccc(c(c1)OC)c1nnc(o1)SCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.0741 |
| logD: | 4.0741 |
| logSw: | -4.3448 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.238 |
| InChI Key: | KNUFPYSBEHUNKG-UHFFFAOYSA-N |