3-methyl-6-{5-[2-(5-methylfuran-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-{5-[2-(5-methylfuran-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one
3-methyl-6-{5-[2-(5-methylfuran-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
Compound ID: | M355-0196 |
Compound Name: | 3-methyl-6-{5-[2-(5-methylfuran-2-yl)ethenyl]-1,2,4-oxadiazol-3-yl}-1,3-benzoxazol-2(3H)-one |
Molecular Weight: | 323.31 |
Molecular Formula: | C17 H13 N3 O4 |
Smiles: | Cc1ccc(/C=C/c2nc(c3ccc4c(c3)OC(N4C)=O)no2)o1 |
Stereo: | ACHIRAL |
logP: | 3.9798 |
logD: | 3.9798 |
logSw: | -4.2052 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 61.438 |
InChI Key: | BYMREOKDQRTSII-UHFFFAOYSA-N |