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5-(p-Fluorophenylazo)-2,4,6-triaminopyrimidine

HCID 200609
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Basic information

CAS
2318-03-8
Standard SMILES
Nc1nc(N)c(N=Nc2ccc(F)cc2)c(N)n1
InChIKey
KWBKQAZZQKBILR-UHFFFAOYSA-N
Molecular formula
C10H10FN7
Average molar mass
247.23 g/mol
Monoisotopic mass
247.09817151

Names & identifiers

Preferred name
5-(p-Fluorophenylazo)-2,4,6-triaminopyrimidine
IUPAC
5-[(4-fluorophenyl)diazenyl]pyrimidine-2,4,6-triamine

Names & synonyms

BRN 0269225PY-905-(p-Fluorophenylazo)-2,4,6-triaminopyrimidine2318-03-8Pyrimidine, 5-(p-fluorophenylazo)-2,4,6-triamino-SCHEMBL30685494

Database identifiers

CAS
2318-03-8
PubChem CID
200609
Nikkaji
J86.921J

Properties

Computed structural properties

XLogP
1
Topological polar surface area
129 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
280

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Compound notes

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