6-(2-(5-(3-Chlorophenyl)-2-oxo-3-oxazolidinyl)propyl)-3-methylthiomethyl-1,4-benzodioxane

HCID 18996331
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Basic information

Standard SMILES
CSCC1COc2ccc(CC(C)N3CC(c4cccc(Cl)c4)OC3=O)cc2O1
InChIKey
MWPMQTFPLVSFFU-UHFFFAOYSA-N
Molecular formula
C22H24ClNO4S
Average molar mass
433.9 g/mol
Monoisotopic mass
433.1114571

Names & identifiers

Preferred name
6-(2-(5-(3-Chlorophenyl)-2-oxo-3-oxazolidinyl)propyl)-3-methylthiomethyl-1,4-benzodioxane
IUPAC
5-(3-chlorophenyl)-3-[1-[3-(methylsulfanylmethyl)-2,3-dihydro-1,4-benzodioxin-6-yl]propan-2-yl]-1,3-oxazolidin-2-one

Names & synonyms

SCHEMBL8974904MWPMQTFPLVSFFU-UHFFFAOYSA-N6-(2-(5-(3-chlorophenyl)-2-oxo-3-oxazolidinyl)propyl)-3-methylthiomethyl-1,4-benzodioxane

Database identifiers

PubChem CID
18996331

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
73.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
29

Related reactions

1 records
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Compound notes

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