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5-(4-(Benzyloxy)-2-oxopyridin-1(2H)-yl)-N-(4-fluorobenzyl)-3-methylthiophene-2-carboxamide

HCID 57744494
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Basic information

Standard SMILES
Cc1cc(-n2ccc(OCc3ccccc3)cc2=O)sc1C(=O)NCc1ccc(F)cc1
InChIKey
XRWPCTCZTSINNV-UHFFFAOYSA-N
Molecular formula
C25H21FN2O3S
Average molar mass
448.5 g/mol

Names & identifiers

Preferred name
5-(4-(Benzyloxy)-2-oxopyridin-1(2H)-yl)-N-(4-fluorobenzyl)-3-methylthiophene-2-carboxamide
IUPAC
N-[(4-fluorophenyl)methyl]-3-methyl-5-(2-oxo-4-phenylmethoxy-1-pyridinyl)thiophene-2-carboxamide

Names & synonyms

SCHEMBL3370350XRWPCTCZTSINNV-UHFFFAOYSA-N5-(4-(Benzyloxy)-2-oxopyridin-1(2H)-yl)-N-(4-fluorobenzyl)-3-methylthiophene-2-carboxamide

Database identifiers

PubChem CID
57744494

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
86.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
32
Formal charge
0
Complexity
729

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Related reactions

2 records
New reaction record
HRID 834440 reaction equation
HRID 834440As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1887301 reaction equation
HRID 1887301As productuspto-grants-2013_08

Compound notes

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