N-[4-(4-butoxyphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-[4-(4-butoxyphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
N-[4-(4-butoxyphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
Compound ID: | D269-1178 |
Compound Name: | N-[4-(4-butoxyphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide |
Molecular Weight: | 391.43 |
Molecular Formula: | C22 H21 N3 O4 |
Smiles: | [H]N(C(c1c(C)c2ccccc2o1)=O)c1c(c2ccc(cc2)OCCCC)non1 |
Stereo: | ACHIRAL |
logP: | 6.2203 |
logD: | 6.0534 |
logSw: | -5.6702 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 76.03 |
InChI Key: | VQFMVVGQUFIUIQ-UHFFFAOYSA-N |