N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-iodobenzamide
Chemical Structure Depiction of
N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-iodobenzamide
N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-iodobenzamide
Compound characteristics
Compound ID: | 2007-0127 |
Compound Name: | N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-2-iodobenzamide |
Molecular Weight: | 502.74 |
Molecular Formula: | C22 H16 Cl I N2 O2 |
Smiles: | Cc1cc2c(cc1C)oc(c1cc(ccc1[Cl])NC(c1ccccc1I)=O)n2 |
Stereo: | ACHIRAL |
logP: | 6.4657 |
logD: | 6.4578 |
logSw: | -6.2505 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.14 |
InChI Key: | QKNLXNOIHQZWKX-UHFFFAOYSA-N |