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5-([1,1'-Biphenyl]-2-yl)-3-methyl-1-(3-(2-methylthiazol-4-yl)benzyl)pyrrolidin-2-one

HCID 69083752
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1nc(-c2cccc(CN3C(=O)C(C)CC3c3ccccc3-c3ccccc3)c2)cs1
InChIKey
UPZMCGJCIWXNRH-UHFFFAOYSA-N
Molecular formula
C28H26N2OS
Average molar mass
438.6 g/mol

Names & identifiers

Preferred name
5-([1,1'-Biphenyl]-2-yl)-3-methyl-1-(3-(2-methylthiazol-4-yl)benzyl)pyrrolidin-2-one
IUPAC
3-methyl-1-[[3-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]-5-(2-phenylphenyl)pyrrolidin-2-one

Names & synonyms

SCHEMBL4538888CHEMBL3931687UPZMCGJCIWXNRH-UHFFFAOYSA-NBDBM203111US9242970, 2905-([1,1'-biphenyl]-2-yl)-3-methyl-1-(3-(2-methylthiazol-4-yl)benzyl)pyrrolidin-2-one

Database identifiers

PubChem CID
69083752
ChEMBL
CHEMBL3931687

Properties

Computed structural propertiesFilling in

XLogP
6.1
Topological polar surface area
61.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
32
Formal charge
0
Complexity
635

Related reactions

1 records
New reaction record
HRID 594675 reaction equation
HRID 594675As productuspto-grants-2016_01

Compound notes

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