2-[3-acetyl-5-(3-ethoxy-4-hydroxyphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-iodophenyl acetate
Chemical Structure Depiction of
2-[3-acetyl-5-(3-ethoxy-4-hydroxyphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-iodophenyl acetate
2-[3-acetyl-5-(3-ethoxy-4-hydroxyphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-iodophenyl acetate
Compound characteristics
Compound ID: | G642-6543 |
Compound Name: | 2-[3-acetyl-5-(3-ethoxy-4-hydroxyphenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-iodophenyl acetate |
Molecular Weight: | 510.28 |
Molecular Formula: | C20 H19 I N2 O6 |
Smiles: | CCOc1cc(ccc1O)C1=NN(C(c2cc(ccc2OC(C)=O)I)O1)C(C)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9623 |
logD: | 3.9621 |
logSw: | -3.6963 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.847 |
InChI Key: | IEFRRQHXLBLJIA-FQEVSTJZSA-N |