(R)-2-[[2-Oxo-3-[4-(3-oxomorpholino)phenyl]-5-oxazolidinyl]methyl]isoindoline-1,3-dione - CAS 1424944-35-3

Name: (R)-2-[[2-Oxo-3-[4-(3-oxomorpholino)phenyl]-5-oxazolidinyl]methyl]isoindoline-1,3-dione
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB009377
Product Name:	(R)-2-[[2-Oxo-3-[4-(3-oxomorpholino)phenyl]-5-oxazolidinyl]methyl]isoindoline-1,3-dione
CAS:	1424944-35-3
Synonyms:	2-[[(5R)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-5-oxazolidinyl]methyl]isoindole-1,3-dione; 2-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]isoindole-1,3-dione

Technical Data

IUPAC Name:	2-[[(5R)-2-oxo-3-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]isoindole-1,3-dione
Description:	(R)-2-[[2-Oxo-3-[4-(3-oxomorpholino)phenyl]-5-oxazolidinyl]methyl]isoindoline-1,3-dione (CAS# 1424944-35-3) is an intermediate in the synthesis of ent-Rivaroxaban (R538005), the R-isomer of Rivaroxaban (R538000), which is a novel antithrombotic agent.
Molecular Weight:	421.40
Molecular Formula:	C22H19N3O6
Canonical SMILES:	C1COCC(=O)N1C2=CC=C(C=C2)N3CC(OC3=O)CN4C(=O)C5=CC=CC=C5C4=O
InChI:	InChI=1S/C22H19N3O6/c26-19-13-30-10-9-23(19)14-5-7-15(8-6-14)24-11-16(31-22(24)29)12-25-20(27)17-3-1-2-4-18(17)21(25)28/h1-8,16H,9-13H2/t16-/m0/s1
InChI Key:	KUQNYAUTIWQAKY-INIZCTEOSA-N
LogP:	1.73910

Publication Number	Title	Priority Date
US-2017267669-A1	Process for the Preparation of Rivaroxaban	20140825
WO-2016030669-A1	Process for the preparation of rivaroxaban	20140825
WO-2015198259-A1	Process for the synthesis of rivaroxaban and intermediate for the production thereof	20140626
WO-2015026761-A1	A process for the preparation of rivaroxaban	20130819
US-9663505-B2	Process for the preparation of rivaroxaban	20130325

Complexity:	740
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	421.12738533
Formal Charge:	0
Heavy Atom Count:	31
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	421.12738533
Rotatable Bond Count:	4
Topological Polar Surface Area:	96.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2