(R)-[3-(3-Fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methyl methanesulfonate

C₁₅H₁₉FN₂O₆SCAS 174649-09-3374.38 g/mol

Open in Covalent MOL file

Aryl halide Carbamate Ether Sulfonate ester Tertiary amine

Properties

Molecular formula: C₁₅H₁₉FN₂O₆S
Molar mass: 374.38 g/mol
Exact mass: 374.0948 Da
logP: 0.96Crippen estimate
Polar surface area: 85.4 Å²
H-bond donors / acceptors: 0 / 7
Rotatable bonds: 5
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

174649-09-3

SMILES

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

InChIKey

UCVIKCGVGWBTTI-GFCCVEGCSA-N

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

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Names and synonyms

1 names

(3-(3-Fluoro-4-morpholinophenyl)-2-oxooxazolidin-5-yl)methyl methanesulfonate, (R)-

Work with (R)-[3-(3-Fluoro-4-morpholinophenyl)-2-oxo-5-oxazolidinyl]methyl methanesulfonate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(5R)-3-(3-Fluoro-4-(4-morpholinyl)phenyl)-5-hydroxymethyl-2-oxazolidione168828-82-869 % similar Linezolid165800-03-363 % similar (5R)-5-(Azidomethyl)-3-[3-fluoro-4-(4-morpholinyl)phenyl]-2-oxazolidinone168828-84-062 % similar Deacetamide linezolid phthalimide168828-89-562 % similar Delpazolid1219707-39-747 % similar 4-[4-[(5S)-5-(Aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]-morpholin-3-one446292-10-038 % similar 4-(2-Fluoro-4-nitrophenyl)morpholine2689-39-636 % similar 4-[4-[(5S)-5-(Aminomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]morpholin-3-one hydrochloride898543-06-136 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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