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| Related CAS: | 391901-45-4 (free base) |
| IUPAC Name: | (1R)-2-[2-(4-aminophenyl)ethylamino]-1-phenylethanol;hydrochloride |
| Description: | An impurity of Mirabegron. Mirabegron (formerly YM-178, trade name Myrbetriq) is a drug for the treatment of overactive bladder. It was developed by Astellas Pharma and was approved in the United States in July 2012. Mirabegron activates the β3 adrenergic receptor in the detrusor muscle in the bladder, which leads to muscle relaxation and an increase in bladder capacity. |
| Molecular Weight: | 292.80 |
| Molecular Formula: | C16H21ClN2O |
| Canonical SMILES: | C1=CC=C(C=C1)[C@H](CNCCC2=CC=C(C=C2)N)O.Cl |
| InChI: | InChI=1S/C16H20N2O.ClH/c17-15-8-6-13(7-9-15)10-11-18-12-16(19)14-4-2-1-3-5-14;/h1-9,16,18-19H,10-12,17H2;1H/t16-;/m0./s1 |
| InChI Key: | QILVTBCJVNFIDP-NTISSMGPSA-N |
| Melting Point: | >127°C (dec.) |
| Solubility: | DMSO (Slightly), Methanol (Slightly) |
| Appearance: | White to Off-White Solid |
| Storage: | -20°C, Hygroscopic |
| References: | Kawazoe, S., et al. PCT Int. Appl., WO 2003037881 A1 20030508 (2003). |
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