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4-Benzyl-3-(2-benzyl-3-hydroxypropanoyl)-1,3-oxazolidin-2-one

HCID 68461237
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Basic information

Standard SMILES
O=C1OCC(Cc2ccccc2)N1C(=O)C(CO)Cc1ccccc1
InChIKey
RIIQQKANBTZNRM-UHFFFAOYSA-N
Molecular formula
C20H21NO4
Average molar mass
339.4 g/mol

Names & identifiers

Preferred name
4-Benzyl-3-(2-benzyl-3-hydroxypropanoyl)-1,3-oxazolidin-2-one
IUPAC
4-benzyl-3-(2-benzyl-3-hydroxypropanoyl)-1,3-oxazolidin-2-one

Names & synonyms

SCHEMBL2970022

Database identifiers

PubChem CID
68461237

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
66.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
455

Related reactions

1 records
New reaction record
HRID 171627 reaction equation
HRID 171627As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

Compound notes

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