AC1NXHC9
4-[(4-amino-3-nitrophenyl)iminomethyl]-2-(4-bromophenyl)-5-methyl-1H-pyrazol-3-one
Also Known As: BAS 00323584|AG-690/09140008|SR-01000313353-1|4-({4-amino-3-nitroanilino}methylene)-2-(4-bromophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one|(4Z)-4-[(4-amino-3-nitroanilino)methylidene]-2-(4-bromophenyl)-5-methylpyrazol-3-one|4-[(4-amino-3-nitroanilino)methylidene]-2-(4-bromophenyl)-5-methylpyrazol-3-one|4-[(4-amino-3-nitrophenyl)iminomethyl]-2-(4-bromophenyl)-5-methyl-1H-pyrazol-3-one|(4E)-4-{[(4-amino-3-nitrophenyl)amino]methylidene}-2-(4-bromophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
| Molecular Formula | C17H14BrN5O3 |
|---|---|
| Molecular Weight | 415.028 g/mol |
| LogP | 3.47752 |
| Topological Polar Surface Area | 119.31 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.028 |
| Monoisotopic Mass | 415.028 |
| Heavy Atoms | 26 |
| Complexity | 1066.9927 |
Chemical Identifiers
| CAS Number | 484653-52-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=C(C=C2)Br)C=NC3=CC(=C(C=C3)N)[N+](=O)[O-] |
Product Overview
AC1NXHC9 (CAS 484653-52-3), with molecular formula C17H14BrN5O3 and molecular weight 415.028 g/mol. IUPAC: 4-[(4-amino-3-nitrophenyl)iminomethyl]-2-(4-bromophenyl)-5-methyl-1H-pyrazol-3-one.