3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-1-benzopyran-8-yl acetate
Chemical Structure Depiction of
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-1-benzopyran-8-yl acetate
3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-1-benzopyran-8-yl acetate
Compound characteristics
| Compound ID: | E594-0276 |
| Compound Name: | 3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-2H-1-benzopyran-8-yl acetate |
| Molecular Weight: | 382.76 |
| Molecular Formula: | C19 H11 Cl N2 O5 |
| Smiles: | CC(=O)Oc1cccc2C=C(C(=O)Oc12)c1nc(c2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.2972 |
| logD: | 4.2972 |
| logSw: | -4.7916 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.088 |
| InChI Key: | KTDTYYWLMFNDMF-UHFFFAOYSA-N |