N-[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide
N-[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2810-1326 |
| Compound Name: | N-[2-(4-chlorophenyl)-2H-benzotriazol-5-yl]-4-methyl-3-nitrobenzamide |
| Molecular Weight: | 407.81 |
| Molecular Formula: | C20 H14 Cl N5 O3 |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(Nc1ccc2c(c1)nn(c1ccc(cc1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2382 |
| logD: | 5.0346 |
| logSw: | -5.8036 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.444 |
| InChI Key: | JQBZQFNQNOREND-UHFFFAOYSA-N |