IUPAC Name: | 4-[4-[(5R)-5-(aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholin-3-onehydrochloride |
Description: | 4-[4-[(5R)-5-(Aminomethyl)-2-oxo-3-oxazolidinyl]phenyl]-3-morpholinone Hydrochloride is an intermediate in the synthesis of ent-Rivaroxaban (R538005), the R-isomer of Rivaroxaban (R538000), which is a novel antithrombotic agent. |
Molecular Weight: | 291.31 + (36.46) |
Molecular Formula: | C14H17N3O4·HCl |
Canonical SMILES: | C1COCC(=O)N1C2=CC=C(C=C2)N3CC(OC3=O)CN.Cl |
InChI: | InChI=1S/C14H17N3O4.ClH/c15-7-12-8-17(14(19)21-12)11-3-1-10(2-4-11)16-5-6-20-9-13(16)18/h1-4,12H,5-9,15H21H/t12-/m1./s1 |
InChI Key: | ITMQDYQHNKXERQ-UTONKHPSSA-N |
Melting Point: | >264°C (dec.) |
Solubility: | DMSO (Slightly, Heated, Sonicated), Water (Slightly, Sonicated) |
Appearance: | White to Off-White Solid |
Storage: | -20°C, Hygroscopic |
References: | Eriksson, B., et al. J. Thromb. Haemost., 3, 103 (2005), Kubitza, D., et al. Clin. Pharmacol. Ther., 78, 412 (2005),. |
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