5-(3,4-diethoxyphenyl)-3-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole
Chemical Structure Depiction of
5-(3,4-diethoxyphenyl)-3-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole
5-(3,4-diethoxyphenyl)-3-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole
Compound characteristics
Compound ID: | F819-0101 |
Compound Name: | 5-(3,4-diethoxyphenyl)-3-[4-(pyrrolidine-1-sulfonyl)phenyl]-1,2,4-oxadiazole |
Molecular Weight: | 443.52 |
Molecular Formula: | C22 H25 N3 O5 S |
Smiles: | CCOc1ccc(cc1OCC)c1nc(c2ccc(cc2)S(N2CCCC2)(=O)=O)no1 |
Stereo: | ACHIRAL |
logP: | 4.0139 |
logD: | 4.0139 |
logSw: | -4.0857 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 78.142 |
InChI Key: | SPQFOTMLILZWLV-UHFFFAOYSA-N |