3-[3-(2-ethyl-1,3-benzoxazol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(2-ethyl-1,3-benzoxazol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
3-[3-(2-ethyl-1,3-benzoxazol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | M416-0422 |
| Compound Name: | 3-[3-(2-ethyl-1,3-benzoxazol-5-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 359.34 |
| Molecular Formula: | C20 H13 N3 O4 |
| Smiles: | CCc1nc2cc(ccc2o1)c1nc(C2=Cc3ccccc3OC2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.4168 |
| logD: | 4.4168 |
| logSw: | -4.4654 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.313 |
| InChI Key: | JIWQLSUDCDVDLV-UHFFFAOYSA-N |