Methyl 4-amino-3-chloro-6-(2,5-difluoro-4-iodophenyl)-5-fluoropicolinate

HCID 90409448
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Basic information

Standard SMILES
COC(=O)c1nc(-c2cc(F)c(I)cc2F)c(F)c(N)c1Cl
InChIKey
IDQBCURGVLNYCV-UHFFFAOYSA-N
Molecular formula
C13H7ClF3IN2O2
Average molar mass
442.56 g/mol

Names & identifiers

Preferred name
Methyl 4-amino-3-chloro-6-(2,5-difluoro-4-iodophenyl)-5-fluoropicolinate
IUPAC
methyl 4-amino-3-chloro-6-(2,5-difluoro-4-iodophenyl)-5-fluoropyridine-2-carboxylate

Names & synonyms

SCHEMBL16036578SCHEMBL29556552IDQBCURGVLNYCV-UHFFFAOYSA-Nmethyl 4-amino-3-chloro-6-(2,5-difluoro-4-iodophenyl)-5-fluoropicolinate

Database identifiers

PubChem CID
90409448

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
65.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
22

Related reactions

1 records
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Compound notes

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