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4-Benzyl-3-[2-(4-methoxyphenyl)propanoyl]-1,3-oxazolidin-2-one (HCID 19918591)|Huagongshe
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Compound
4-Benzyl-3-[2-(4-methoxyphenyl)propanoyl]-1,3-oxazolidin-2-one
HCID
19918591
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
COc1ccc(C(C)C(=O)N2C(=O)OCC2Cc2ccccc2)cc1
InChIKey
RGRPPZUPQFZPPD-UHFFFAOYSA-N
Molecular formula
C20H21NO4
Average molar mass
339.4 g/mol
Names & identifiers
Preferred name
4-Benzyl-3-[2-(4-methoxyphenyl)propanoyl]-1,3-oxazolidin-2-one
IUPAC
4-benzyl-3-[2-(4-methoxyphenyl)propanoyl]-1,3-oxazolidin-2-one
Names & synonyms
SCHEMBL2370679
Database identifiers
PubChem CID
19918591
Properties
Computed structural properties
XLogP
3.8
Topological polar surface area
55.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
25
Formal charge
0
Complexity
466
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Related reactions
3 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
154951
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
158163
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID
1537540
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Compound notes
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