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4-Chloro-6-iodoquinoline-3-carboxamide

HCID 57763271
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
NC(=O)c1cnc2ccc(I)cc2c1Cl
InChIKey
PIHLRIUMIVAHDZ-UHFFFAOYSA-N
Molecular formula
C10H6ClIN2O
Average molar mass
332.52 g/mol

Names & identifiers

Preferred name
4-Chloro-6-iodoquinoline-3-carboxamide
IUPAC
4-chloro-6-iodoquinoline-3-carboxamide

Names & synonyms

4-Chloro-6-iodoquinoline-3-carboxamide801315-30-0SCHEMBL2479384PIHLRIUMIVAHDZ-UHFFFAOYSA-N4-Chloro-6-iodo-3-quinolinecarboxamide

Database identifiers

PubChem CID
57763271

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
56 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
264

Related reactions

3 records
New reaction record
HRID 230838 reaction equation
HRID 230838As reactantuspto-grants-2009_07
HRID 230839 reaction equation
HRID 230839As reactantuspto-grants-2009_07
HRID 2325974 reaction equation
HRID 2325974As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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