2-bromo-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-5-nitrobenzamide
Chemical Structure Depiction of
2-bromo-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-5-nitrobenzamide
2-bromo-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 3553-1947 |
| Compound Name: | 2-bromo-N-[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]-5-nitrobenzamide |
| Molecular Weight: | 482.29 |
| Molecular Formula: | C21 H16 Br N5 O4 |
| Smiles: | Cc1cc2c(cc1NC(c1cc(ccc1[Br])[N+]([O-])=O)=O)nn(c1ccc(cc1)OC)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.584 |
| logD: | 3.6725 |
| logSw: | -4.5197 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.591 |
| InChI Key: | BGVLHGNJWLVHFH-UHFFFAOYSA-N |