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N-(2,4-difluorobenzyl)-2-(2,6-difluorophenyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide

HCID 54711751
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cn1c(-c2c(F)cccc2F)nc(C(=O)NCc2ccc(F)cc2F)c(O)c1=O
InChIKey
RMDBMTOWYRVKAZ-UHFFFAOYSA-N
Molecular formula
C19H13F4N3O3
Average molar mass
407.3 g/mol

Names & identifiers

Preferred name
N-(2,4-difluorobenzyl)-2-(2,6-difluorophenyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide
IUPAC
2-(2,6-difluorophenyl)-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-1-methyl-6-oxopyrimidine-4-carboxamide

Names & synonyms

SCHEMBL6017974RMDBMTOWYRVKAZ-UHFFFAOYSA-NN-(2,4-difluorobenzyl)-2-(2,6-difluorophenyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide

Database identifiers

PubChem CID
54711751

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
82 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
4
Heavy atoms
29
Formal charge
0
Complexity
719

Related reactions

2 records
New reaction record
HRID 835278 reaction equation
HRID 835278As productTest data from https://doi.org/10.1039/C8SC04228D
HRID 1822689 reaction equation
HRID 1822689As productuspto-grants-2006_05

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes