6-bromo-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
6-bromo-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0216 |
| Compound Name: | 6-bromo-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 375.2 |
| Molecular Formula: | C15 H7 Br N2 O3 S |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[Br])c1nc(c2cccs2)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.2241 |
| logD: | 4.2241 |
| logSw: | -4.6204 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.584 |
| InChI Key: | HHBFICWCSQZKRJ-UHFFFAOYSA-N |