2-bromo-N-[2-(3-nitrophenyl)-2H-benzotriazol-5-yl]benzamide
Chemical Structure Depiction of
2-bromo-N-[2-(3-nitrophenyl)-2H-benzotriazol-5-yl]benzamide
2-bromo-N-[2-(3-nitrophenyl)-2H-benzotriazol-5-yl]benzamide
Compound characteristics
| Compound ID: | 3370-3874 |
| Compound Name: | 2-bromo-N-[2-(3-nitrophenyl)-2H-benzotriazol-5-yl]benzamide |
| Molecular Weight: | 438.24 |
| Molecular Formula: | C19 H12 Br N5 O3 |
| Smiles: | c1ccc(c(c1)C(Nc1ccc2c(c1)nn(c1cccc(c1)[N+]([O-])=O)n2)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4491 |
| logD: | 4.335 |
| logSw: | -4.5418 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.745 |
| InChI Key: | XXYHCDHIGCIBDQ-UHFFFAOYSA-N |