N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide
N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | D491-4656 |
Compound Name: | N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 475.28 |
Molecular Formula: | C18 H11 Br N4 O5 S |
Smiles: | [H]N(C(c1cc(c2ccc3c(c2)OCCO3)on1)=O)c1nc(c2ccc(o2)[Br])ns1 |
Stereo: | ACHIRAL |
logP: | 3.6602 |
logD: | 3.6599 |
logSw: | -4.1197 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 90.201 |
InChI Key: | VNECJXBXAIUDJP-UHFFFAOYSA-N |