8-methyl-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methyl-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
8-methyl-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | E594-0461 |
| Compound Name: | 8-methyl-3-[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 310.33 |
| Molecular Formula: | C16 H10 N2 O3 S |
| Smiles: | Cc1cccc2C=C(C(=O)Oc12)c1nc(c2cccs2)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.0621 |
| logD: | 4.0621 |
| logSw: | -4.3635 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.269 |
| InChI Key: | HMWLGNLMHJJEPH-UHFFFAOYSA-N |