4-methoxy-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)-3-nitrobenzamide
Chemical Structure Depiction of
4-methoxy-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)-3-nitrobenzamide
4-methoxy-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | 3616-1896 |
| Compound Name: | 4-methoxy-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)-3-nitrobenzamide |
| Molecular Weight: | 403.4 |
| Molecular Formula: | C21 H17 N5 O4 |
| Smiles: | Cc1cc2c(cc1NC(c1ccc(c(c1)[N+]([O-])=O)OC)=O)nn(c1ccccc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.5544 |
| logD: | 3.4056 |
| logSw: | -3.7931 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.377 |
| InChI Key: | KCRGCTAWDICWGS-UHFFFAOYSA-N |