6-bromo-3-[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one
6-bromo-3-[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 2041-2457 |
| Compound Name: | 6-bromo-3-[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 448.07 |
| Molecular Formula: | C17 H8 Br2 N2 O3 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[Br])c1nnc(c2cccc(c2)[Br])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.5413 |
| logD: | 4.5413 |
| logSw: | -4.7188 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.404 |
| InChI Key: | CYGWRIYQKGXDNR-UHFFFAOYSA-N |