4-(4-Fluoro-2-methyl-phenyl)-6-(2-fluoro-phenylamino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde

HCID 59639656
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Basic information

Standard SMILES
CSc1nc(Nc2ccccc2F)c(C=O)c(-c2ccc(F)cc2C)n1
InChIKey
RQVNFYJQEZPLFO-UHFFFAOYSA-N
Molecular formula
C19H15F2N3OS
Average molar mass
371.4 g/mol

Names & identifiers

Preferred name
4-(4-Fluoro-2-methyl-phenyl)-6-(2-fluoro-phenylamino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde
IUPAC
4-(2-fluoroanilino)-6-(4-fluoro-2-methylphenyl)-2-methylsulfanylpyrimidine-5-carbaldehyde

Names & synonyms

SCHEMBL1063918RQVNFYJQEZPLFO-UHFFFAOYSA-N4-(4-fluoro-2-methyl-phenyl)-6-(2-fluoro-phenylamino)-2-methylsulfanyl-pyrimidine-5-carbaldehyde

Database identifiers

PubChem CID
59639656

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
80.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
26

Related reactions

6 records
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Compound notes

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