AC1M198R
(E)-4-[[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]methylamino]-4-oxobut-2-enoic acid
Also Known As: F1683-2873|(2E)-3-({[3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}carbamoyl)prop-2-enoic acid|(E)-4-[[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]methylamino]-4-oxobut-2-enoic acid|(E)-4-(((3-(4-bromophenyl)-1-phenyl-1H-pyrazol-4-yl)methyl)amino)-4-oxobut-2-enoic acid|3-[[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]methylcarbamoyl]prop-2-enoic Acid
| Molecular Formula | C20H16BrN3O3 |
|---|---|
| Molecular Weight | 425.0375 g/mol |
| LogP | 3.5588 |
| Topological Polar Surface Area | 84.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 425.0375 |
| Monoisotopic Mass | 425.0375 |
| Heavy Atoms | 27 |
| Complexity | 979.4664 |
Chemical Identifiers
| CAS Number | 957047-72-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Br)CNC(=O)/C=C/C(=O)O |
Product Overview
AC1M198R (CAS 957047-72-2), with molecular formula C20H16BrN3O3 and molecular weight 425.0375 g/mol. IUPAC: (E)-4-[[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]methylamino]-4-oxobut-2-enoic acid.
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