N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-2-nitrobenzamide
N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-2-nitrobenzamide
Compound characteristics
Compound ID: | 2079-0020 |
Compound Name: | N-[2-(5-bromonaphthalen-1-yl)-1,3-benzoxazol-5-yl]-2-nitrobenzamide |
Molecular Weight: | 488.3 |
Molecular Formula: | C24 H14 Br N3 O4 |
Smiles: | c1ccc(c(c1)C(Nc1ccc2c(c1)nc(c1cccc3c(cccc13)[Br])o2)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 5.9013 |
logD: | 5.6489 |
logSw: | -6.1876 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.949 |
InChI Key: | KRAMDLZWVXXRNN-UHFFFAOYSA-N |