2-[(4-phenoxybutyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[(4-phenoxybutyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
2-[(4-phenoxybutyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 3075-0816 |
| Compound Name: | 2-[(4-phenoxybutyl)sulfanyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole |
| Molecular Weight: | 416.49 |
| Molecular Formula: | C21 H24 N2 O5 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnc(o1)SCCCCOc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2051 |
| logD: | 4.2051 |
| logSw: | -4.2544 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.46 |
| InChI Key: | SJGKQHSKBKYQFK-UHFFFAOYSA-N |