4-ethyl-6-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-ethyl-6-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2H-1,4-benzoxazin-3(4H)-one
4-ethyl-6-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L834-0600 |
| Compound Name: | 4-ethyl-6-[5-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 411.41 |
| Molecular Formula: | C21 H21 N3 O6 |
| Smiles: | CCN1C(COc2ccc(cc12)c1nc(c2cc(c(c(c2)OC)OC)OC)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0968 |
| logD: | 3.0968 |
| logSw: | -3.2848 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.448 |
| InChI Key: | MFMTWCKLQHVAMD-UHFFFAOYSA-N |