Mapenterol
1-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-(2-methylbutan-2-ylamino)ethanol
Also Known As: Mapenterol|Mapenterol (hydrochloride)|1-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-(2-methylbutan-2-ylamino)ethanol|MSK1379-100M|MSK1379-1000M|1-[4-amino-3-chloro-5- phenyl]-2- ethanol|Mapenterol Solution in Methanol, 1000ug/mL|1-[4-Amino-3-chloro-5-(trifluoromethyl)phenyl]-2-[(2-methylbutan-2-yl)amino]ethan-1-ol|Benzenemethanol, 4-amino-3-chloro-alpha-(((1,1-dimethylpropyl)amino)methyl)-5-(trifluoromethyl)-|1-(4'-Amino-3'-chloro-5'-trifluoromethyl-phenyl)-2-tert-pentylamino-ethanol|1-(4'-Amino-3'-chloro-5'-trifluoromethyl-phenyl)-2-tert.pentylamino-ethanol|4-Amino-5-chloro-3-(trifluoromethyl)-N-(1,1-dimethylpropyl)-beta-hydroxybenzeneethanamine|4-Amino-3-chloro-alpha-[[(1,1-dimethylpropyl)amino]methyl]-5-(trifluoromethyl)benzenemethanol|Mapenterol Solution in Methanol, 100ug/mL; 1-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-(2-methylbutan-2-ylamino)ethanol|Mapenterol; Benzenemethanol, 4-amino-3-chloro-a-[[(1,1-dimethylpropyl)amino]methyl]-5-(trifluoromethyl)-; 4-Amino-3-chloro-a-[[(1,1-dimethylpropyl)amino]methyl]-5-(trifluoromethyl)benzenemethanol; Mapenterol
| Molecular Formula | C14H20ClF3N2O |
|---|---|
| Molecular Weight | 324.1216 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 58.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.1216 |
| Monoisotopic Mass | 324.1216 |
| Heavy Atoms | 21 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 95656-68-1 |
|---|---|
| SMILES | CCC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)C(F)(F)F)O |
| InChIKey | KGOIKOVSEVRHNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Mapenterol (CAS 95656-68-1), with molecular formula C14H20ClF3N2O and molecular weight 324.1216 g/mol. IUPAC: 1-[4-amino-3-chloro-5-(trifluoromethyl)phenyl]-2-(2-methylbutan-2-ylamino)ethanol.
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