6-bromo-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
6-bromo-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0042 |
| Compound Name: | 6-bromo-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 370.16 |
| Molecular Formula: | C16 H8 Br N3 O3 |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[Br])c1nc(c2cccnc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.0821 |
| logD: | 2.998 |
| logSw: | -3.1727 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.084 |
| InChI Key: | SXINZDJPJPECOK-UHFFFAOYSA-N |