3-[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one
3-[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 1564-0044 |
| Compound Name: | 3-[5-(3-chlorophenyl)-1,3,4-oxadiazol-2-yl]-6-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 354.75 |
| Molecular Formula: | C18 H11 Cl N2 O4 |
| Smiles: | COc1ccc2c(C=C(C(=O)O2)c2nnc(c3cccc(c3)[Cl])o2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6204 |
| logD: | 3.6204 |
| logSw: | -4.1467 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.948 |
| InChI Key: | RYJUGPBPRLCSGV-UHFFFAOYSA-N |