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Linezolid N-Oxide

CAT: 1596-AR-L05896-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-L05896-01Size:10 Units
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CAS Number
189038-36-6
Synonyms
N-[[ (5S) -3-[3-fluoro-4- (4-oxido-4-morpholinyl) phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide; (S) -N-[[3-[3-Fluoro-4- (4-oxido-4-morpholinyl) phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide; N-[[ (5S) -3-[3-fluoro-4- (4-oxido-4-morpholinyl) phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide; (S) -N-[[3-[3-Fluoro-4- (4-oxido-4-morpholinyl) phenyl]-2-oxo-5-oxazolidinyl]methyl]acetamide; (R) -4- (4- (5- (acetamidomethyl) -2-oxooxazolidin-3-yl) -2-fluorophenyl) morpholine 4-oxide
Molecular Formula
C16H20FN3O5
Molecular Weight
353.35
API Name
Linezolid

Chemical Information

Linezolid N-oxide
CAS Number189038-36-6
PubChem CID486305
IUPAC NameN-[[(5S)-3-[3-fluoro-4-(4-oxidomorpholin-4-ium-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Molecular FormulaC16H20FN3O5
Molecular Weight353.35
XLogP-0.1
Topological Polar Surface Area85.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity514
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)[N+]3(CCOCC3)[O-])F
InChI
InChI=1S/C16H20FN3O5/c1-11(21)18-9-13-10-19(16(22)25-13)12-2-3-15(14(17)8-12)20(23)4-6-24-7-5-20/h2-3,8,13H,4-7,9-10H2,1H3,(H,18,21)/t13-/m0/s1
InChIKey
CMFKNYFIQWSUNN-ZDUSSCGKSA-N
Chemical Structure
2D Structure
2D structure of Linezolid N-oxide
CAS: 189038-36-6
CID: 486305
Formula: C16H20FN3O5
MW: 353.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight353.35
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass353.13869891
Monoisotopic Mass353.13869891
Topological Polar Surface Area85.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity514
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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