Metoprolol Impurity B
N-[[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylideneamino]-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
Also Known As: Metoprolol Impurity B|N-[[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylideneamino]-2-(1-phenyltetrazol-5-yl)sulfanylacetamide|N-[[5-(2-METHOXY-5-NITRO-PHENYL)-2-FURYL]METHYLIDENEAMINO]-2-(1-PHENYLTETRAZOL-5-YL)SULFANYL-ACETAMIDE|N'-{[5-(2-Methoxy-5-nitrophenyl)furan-2-yl]methylidene}-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]acetohydrazide
| Molecular Formula | C21H17N7O5S |
|---|---|
| Molecular Weight | 479.1012 g/mol |
| LogP | 3.0815 |
| Topological Polar Surface Area | 150.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 479.1012 |
| Monoisotopic Mass | 479.1012 |
| Heavy Atoms | 34 |
| Complexity | 1336.303 |
Chemical Identifiers
| CAS Number | 5672-22-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=C(O2)C=NNC(=O)CSC3=NN=NN3C4=CC=CC=C4 |
Product Overview
Metoprolol Impurity B (CAS 5672-22-0), with molecular formula C21H17N7O5S and molecular weight 479.1012 g/mol. IUPAC: N-[[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylideneamino]-2-(1-phenyltetrazol-5-yl)sulfanylacetamide.
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