2-[3-(pyrrolidine-1-sulfonyl)phenyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[3-(pyrrolidine-1-sulfonyl)phenyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
2-[3-(pyrrolidine-1-sulfonyl)phenyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | J057-0542 |
| Compound Name: | 2-[3-(pyrrolidine-1-sulfonyl)phenyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | COc1cc(cc(c1OC)OC)c1nnc(c2cccc(c2)S(N2CCCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.8077 |
| logD: | 2.8077 |
| logSw: | -3.248 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.537 |
| InChI Key: | IBKXINZFYGLSGK-UHFFFAOYSA-N |