2-(3,4-dimethoxyphenyl)-5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(3,4-dimethoxyphenyl)-5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole
2-(3,4-dimethoxyphenyl)-5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | J057-0659 |
| Compound Name: | 2-(3,4-dimethoxyphenyl)-5-[4-methoxy-3-(pyrrolidine-1-sulfonyl)phenyl]-1,3,4-oxadiazole |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | COc1ccc(cc1OC)c1nnc(c2ccc(c(c2)S(N2CCCC2)(=O)=O)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.6738 |
| logD: | 2.6738 |
| logSw: | -2.9809 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.451 |
| InChI Key: | IIJREHLTQNVGMK-UHFFFAOYSA-N |