3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-2H-1-benzopyran-2-one
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0108 |
| Compound Name: | 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-7-hydroxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 340.72 |
| Molecular Formula: | C17 H9 Cl N2 O4 |
| Smiles: | C1=C(C(=O)Oc2cc(ccc12)O)c1nc(c2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 3.9865 |
| logD: | 3.9137 |
| logSw: | -4.4394 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.183 |
| InChI Key: | SRLGCQPMKJGGNY-UHFFFAOYSA-N |