N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-5-nitrofuran-2-carboxamide
Chemical Structure Depiction of
N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-5-nitrofuran-2-carboxamide
N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-5-nitrofuran-2-carboxamide
Compound characteristics
Compound ID: | 2081-1774 |
Compound Name: | N-[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]-5-nitrofuran-2-carboxamide |
Molecular Weight: | 365.3 |
Molecular Formula: | C18 H11 N3 O6 |
Smiles: | c1ccc2c(c1)nc(c1cc(ccc1O)NC(c1ccc([N+]([O-])=O)o1)=O)o2 |
Stereo: | ACHIRAL |
logP: | 4.1912 |
logD: | 4.1909 |
logSw: | -4.1407 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 99.348 |
InChI Key: | UTTCQOBFSDNMDI-UHFFFAOYSA-N |