5-Amino-6-(4-fluoro-phenyl)-pyrazine-2-carboxylic acid methyl ester

HCID 67504641

Basic information

Standard SMILES
COC(=O)c1cnc(N)c(-c2ccc(F)cc2)n1
InChIKey
KGLYICHUFXQCOT-UHFFFAOYSA-N
Molecular formula
C12H10FN3O2
Average molar mass
247.22 g/mol

Names & identifiers

Preferred name
5-Amino-6-(4-fluoro-phenyl)-pyrazine-2-carboxylic acid methyl ester
IUPAC
methyl 5-amino-6-(4-fluorophenyl)pyrazine-2-carboxylate

Names & synonyms

SCHEMBL2701893KGLYICHUFXQCOT-UHFFFAOYSA-NAT52965methyl 5-amino-6-(4-fluorophenyl)pyrazine-2-carboxylate5-Amino-6-(4-fluoro-phenyl)-pyrazine-2-carboxylic acid methyl ester960247-69-2

Database identifiers

PubChem CID
67504641

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
78.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
18

Related reactions

9 records

Compound notes

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