C16H11BrN6O
1-[(4-bromo-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methyl]imidazole-4,5-dicarbonitrile
Also Known As: 1-[(4-bromo-2-methyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrazol-3-yl)methyl]-1H-imidazole-4,5-dicarbonitrile|KS-000028YU|MS-7119|1-[(4-bromo-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methyl]imidazole-4,5-dicarbonitrile|1-((4-BROMO-2-METHYL-5-OXO-1-PHENYL-3-PYRAZOLIN-3-YL)METHYL)IMIDAZOLE-4,5-DICARBONITRILE|1-[(4-bromo-2-methyl-5-oxo-1-phenyl-pyrazol-3-yl)methyl]imidazole-4,5-dicarbonitrile|1-(4-Bromo-2-methyl-5-oxo-1-phenyl-2,5-dihydro-1H-pyrazol-3-yl)methyl-1H-imidazole-4,5-dicarbonitrile
| Molecular Formula | C16H11BrN6O |
|---|---|
| Molecular Weight | 382.01776 g/mol |
| LogP | 1.92666 |
| Topological Polar Surface Area | 92.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.01776 |
| Monoisotopic Mass | 382.01776 |
| Heavy Atoms | 24 |
| Complexity | 1045.4014 |
Chemical Identifiers
| CAS Number | 1024232-73-2 |
|---|---|
| SMILES | CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)CN3C=NC(=C3C#N)C#N |
Product Overview
C16H11BrN6O (CAS 1024232-73-2), with molecular formula C16H11BrN6O and molecular weight 382.01776 g/mol. IUPAC: 1-[(4-bromo-2-methyl-5-oxo-1-phenylpyrazol-3-yl)methyl]imidazole-4,5-dicarbonitrile.