N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-nitrobenzamide
N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | F019-0652 |
| Compound Name: | N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-nitrobenzamide |
| Molecular Weight: | 387.4 |
| Molecular Formula: | C21 H17 N5 O3 |
| Smiles: | CCc1ccc(cc1)n1nc2ccc(cc2n1)NC(c1ccccc1[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9147 |
| logD: | 3.884 |
| logSw: | -4.5964 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.444 |
| InChI Key: | IQLMNGNHSYBGIO-UHFFFAOYSA-N |