6-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2H-1,4-benzoxazin-3(4H)-one
6-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | L834-0602 |
| Compound Name: | 6-[5-(4-bromophenyl)-1,2,4-oxadiazol-3-yl]-4-ethyl-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 400.23 |
| Molecular Formula: | C18 H14 Br N3 O3 |
| Smiles: | CCN1C(COc2ccc(cc12)c1nc(c2ccc(cc2)[Br])on1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3531 |
| logD: | 4.3531 |
| logSw: | -4.4677 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.47 |
| InChI Key: | VGSKPEMBVFRCHT-UHFFFAOYSA-N |