CAS 174649-09-3

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5 End Use APIs
16 Related Intermediates

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Also known as: 174649-09-3, (r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methyl methanesulfonate, Linezolid mesylate ester, D02quu2jky, [(5r)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl methanesulfonate, Linezolid related compound d [usp-rs]

Molecular Formula

C₁₅H₁₉FN₂O₆S

Molecular Weight

374.4 g/mol

InChI Key

UCVIKCGVGWBTTI-GFCCVEGCSA-N

FDA UNII

D02QUU2JKY

1 2D Structure

CAS 174649-09-3

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(5R)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl methanesulfonate

2.1.2 InChI

InChI=1S/C15H19FN2O6S/c1-25(20,21)23-10-12-9-18(15(19)24-12)11-2-3-14(13(16)8-11)17-4-6-22-7-5-17/h2-3,8,12H,4-7,9-10H2,1H3/t12-/m1/s1

2.1.3 InChI Key

UCVIKCGVGWBTTI-GFCCVEGCSA-N

2.1.4 Canonical SMILES

CS(=O)(=O)OCC1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F

2.1.5 Isomeric SMILES

CS(=O)(=O)OC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F

2.2 Other Identifiers

2.2.1 UNII

D02QUU2JKY

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 174649-09-3

2. (r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methyl Methanesulfonate

3. Linezolid Mesylate Ester

4. D02quu2jky

5. [(5r)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl Methanesulfonate

6. Linezolid Related Compound D [usp-rs]

7. (3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl Methanesulfonate, (r)-

8. (5r)-3-(3-fluoro-4-(4-morpholinyl)phenyl)-5-(((methylsulfonyl)oxy)methyl)-2-oxazolidinone

9. (5r)-3-[3-fluoro-4-(4-morpholinyl)phenyl]-5-[[(methylsulfonyl)oxy]methyl]-2-oxazolidinone

10. 2-oxazolidinone, 3-(3-fluoro-4-(4-morpholinyl)phenyl)-5-(((methylsulfonyl)oxy)methyl)-, (r)-

11. 2-oxazolidinone, 3-[3-fluoro-4-(4-morpholinyl)phenyl]-5-[[(methylsulfonyl)oxy]methyl]-, (5r)-

12. Unii-d02quu2jky

13. Linezolid Related Compound D

14. Schembl12126884

15. Dtxsid70442918

16. Linezolid Related Compound D [usp]

17. Mfcd18070719

18. Zinc39140048

19. Akos015913626

20. Ds-3714

21. (r)-(3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methylmethanesulfonate

22. Am20030162

23. Cs-0150118

24. D78062

25. A851827

26. J-502106

27. Linezolid Related Compound D [usp Impurity]

28. ((r)-3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl Methanesulfonate

29. ((r)-n-[[3-[3-fluro-4-morpholinyl]-phenyl]-2-oxo-5-oxazolidinyl]methyl] Methane Sulfonate

30. (5r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl]methyl Methanesulfonate

31. (r)-[3-(3-fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methylmethanesulfonate

32. {(5r)-3-[3-fluoro-4-(morpholin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl}methyl Methanesulfonate

33. 2-oxazolidinone, 3-[3-fluoro-4-(4-morpholinyl)phenyl]-5-[[(methylsulfonyl)oxy]methyl]-, (5r)

34. Methyl ((r)-3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methanesulfonate;(r)-(3-(3-fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl Methanesulfonate

2.4 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₁₉FN₂O₆S
Molecular Weight	374.4 g/mol
XLogP3	0.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	374.09478567 g/mol
Monoisotopic Mass	374.09478567 g/mol
Topological Polar Surface Area	93.8 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	577
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1