2-(4-methoxyphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
2-(4-methoxyphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | F982-0053 |
| Compound Name: | 2-(4-methoxyphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one |
| Molecular Weight: | 485.5 |
| Molecular Formula: | C27 H23 N3 O6 |
| Smiles: | COc1ccc(cc1)N1C=C(c2ccccc2C1=O)c1nc(c2cc(c(c(c2)OC)OC)OC)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.9527 |
| logD: | 3.9527 |
| logSw: | -4.2389 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.682 |
| InChI Key: | XQHJQULIPMWJKC-UHFFFAOYSA-N |