N-{2-[4-(diethylamino)phenyl]-6-methyl-2H-benzotriazol-5-yl}-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-{2-[4-(diethylamino)phenyl]-6-methyl-2H-benzotriazol-5-yl}-2-methyl-3-nitrobenzamide
N-{2-[4-(diethylamino)phenyl]-6-methyl-2H-benzotriazol-5-yl}-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 8370-0825 |
| Compound Name: | N-{2-[4-(diethylamino)phenyl]-6-methyl-2H-benzotriazol-5-yl}-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 458.52 |
| Molecular Formula: | C25 H26 N6 O3 |
| Smiles: | CCN(CC)c1ccc(cc1)n1nc2cc(C)c(cc2n1)NC(c1cccc(c1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2286 |
| logD: | 4.6441 |
| logSw: | -5.1732 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.483 |
| InChI Key: | IYNDZAPVAJSBED-UHFFFAOYSA-N |