N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide
Compound characteristics
Compound ID: | D491-4654 |
Compound Name: | N-[3-(5-bromofuran-2-yl)-1,2,4-thiadiazol-5-yl]-5-(4-methoxyphenyl)-1,2-oxazole-3-carboxamide |
Molecular Weight: | 447.26 |
Molecular Formula: | C17 H11 Br N4 O4 S |
Smiles: | [H]N(C(c1cc(c2ccc(cc2)OC)on1)=O)c1nc(c2ccc(o2)[Br])ns1 |
Stereo: | ACHIRAL |
logP: | 4.6759 |
logD: | 4.6756 |
logSw: | -4.5058 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 81.922 |
InChI Key: | AKDSTVAGYZCDCG-UHFFFAOYSA-N |