N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-methyl-3-nitrobenzamide
N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2466-0480 |
| Compound Name: | N-[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C21 H14 Cl N3 O4 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(Nc1cc(ccc1[Cl])c1nc2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.51 |
| logD: | 5.4909 |
| logSw: | -6.003 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.523 |
| InChI Key: | PFMZYGMDRJSMGG-UHFFFAOYSA-N |