2-Iodobenzoylacebutolol
N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-(125I)iodo(125I)benzamide
Also Known As: 2-Iodobenzoylacebutolol|ortho-Iodobenzoylacebutolol|N-(3-Acetyl-4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-2-iodobenzamide|N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-(125I)iodanylbenzamide|N (3-acetyl-4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)phenyl)-2-iodobenzamide|N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-iodanylbenzamide|N-(3-Acetyl-4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)-2-(~125~I)iodobenzene-1-carboximidic acid
| Molecular Formula | C21H25IN2O4 |
|---|---|
| Molecular Weight | 494.08606 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 494.08606 |
| Monoisotopic Mass | 494.08606 |
| Heavy Atoms | 28 |
| Complexity | 517.0 |
Chemical Identifiers
| CAS Number | 72249-69-5 |
|---|---|
| SMILES | CC(C)NCC(COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2[125I])C(=O)C)O |
| InChIKey | KXNPTVLZWGRHRX-ONBQKKEBSA-N |
Product Overview
2-Iodobenzoylacebutolol (CAS 72249-69-5), with molecular formula C21H25IN2O4 and molecular weight 494.08606 g/mol. IUPAC: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-(125I)iodo(125I)benzamide.
2-Iodobenzoylacebutolol is a custom synthesis product. We offer services from milligram to kilogram scale.
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