6-(4,6-Dimethoxypyrimidin-5-yl)-1-(3-(2-methylthiazol-4-yl)benzyl)piperidin-2-one

HCID 69085145
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Basic information

Standard SMILES
COc1ncnc(OC)c1C1CCCC(=O)N1Cc1cccc(-c2csc(C)n2)c1
InChIKey
AERREAAADMJGLC-UHFFFAOYSA-N
Molecular formula
C22H24N4O3S
Average molar mass
424.5 g/mol

Names & identifiers

Preferred name
6-(4,6-Dimethoxypyrimidin-5-yl)-1-(3-(2-methylthiazol-4-yl)benzyl)piperidin-2-one
IUPAC
6-(4,6-dimethoxypyrimidin-5-yl)-1-[[3-(2-methyl-1,3-thiazol-4-yl)phenyl]methyl]piperidin-2-one

Names & synonyms

SCHEMBL4541596CHEMBL3903513AERREAAADMJGLC-UHFFFAOYSA-NBDBM203090US9242970, 2696-(4,6-dimethoxypyrimidin-5-yl)-1-(3-(2-methylthiazol-4-yl)benzyl)piperidin-2-one

Database identifiers

PubChem CID
69085145
ChEMBL
CHEMBL3903513

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
106 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
30

Related reactions

1 records
New reaction record

Compound notes

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6-(4,6-Dimethoxypyrimidin-5-yl)-1-(3-(2-methylthiazol-4-yl)benzyl)piperidin-2-one (HCID 69085145)｜Huagongshe