3-{[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
3-{[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-1,2,3-benzotriazin-4(3H)-one
3-{[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
Compound ID: | G851-0698 |
Compound Name: | 3-{[5-(5-bromofuran-2-yl)-1,2,4-oxadiazol-3-yl]methyl}-1,2,3-benzotriazin-4(3H)-one |
Molecular Weight: | 374.15 |
Molecular Formula: | C14 H8 Br N5 O3 |
Smiles: | C(c1nc(c2ccc(o2)[Br])on1)N1C(c2ccccc2N=N1)=O |
Stereo: | ACHIRAL |
logP: | 2.7931 |
logD: | 2.7931 |
logSw: | -3.4871 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 82.526 |
InChI Key: | MIZVOQSZJFPCRP-UHFFFAOYSA-N |