2-(4-ethylphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-ethylphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
2-(4-ethylphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Compound characteristics
Compound ID: | F982-0746 |
Compound Name: | 2-(4-ethylphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one |
Molecular Weight: | 483.52 |
Molecular Formula: | C28 H25 N3 O5 |
Smiles: | CCc1ccc(cc1)N1C=C(c2ccccc2C1=O)c1nc(c2cc(c(c(c2)OC)OC)OC)no1 |
Stereo: | ACHIRAL |
logP: | 4.901 |
logD: | 4.901 |
logSw: | -4.6667 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 70.138 |
InChI Key: | MCRJJLWCQGIORK-UHFFFAOYSA-N |