N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide
Compound characteristics
Compound ID: | 3205-2264 |
Compound Name: | N-[5-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-ethoxy-3-nitrobenzamide |
Molecular Weight: | 445.47 |
Molecular Formula: | C25 H23 N3 O5 |
Smiles: | CCOc1ccc(cc1[N+]([O-])=O)C(Nc1cc(ccc1C)c1nc2cc(C)cc(C)c2o1)=O |
Stereo: | ACHIRAL |
logP: | 5.4283 |
logD: | 5.4281 |
logSw: | -5.3665 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.966 |
InChI Key: | ORBAFDAYWXCXFO-UHFFFAOYSA-N |