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7-Cyclobutyl-5-iodo-imidazo[5,1-f][1,2,4]triazin-4-ylamine

HCID 53328624
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1ncnn2c(C3CCC3)nc(I)c12
InChIKey
MAFCYUSZGLOIIA-UHFFFAOYSA-N
Molecular formula
C9H10IN5
Average molar mass
315.11 g/mol

Names & identifiers

Preferred name
7-Cyclobutyl-5-iodo-imidazo[5,1-f][1,2,4]triazin-4-ylamine
IUPAC
7-cyclobutyl-5-iodoimidazo[5,1-f][1,2,4]triazin-4-amine

Names & synonyms

SCHEMBL397549MAFCYUSZGLOIIA-UHFFFAOYSA-N7-cyclobutyl-5-iodo-imidazo[5,1-f][1,2,4]triazin-4-ylamineDB-1974867-Cyclobutyl-5-iodo-imidazo[5,1-f][1,2,4]triazin-4-amine7-cyclobutyl-5-iodoimidazo[5,1-f][1,2,4]triazin-4-ylamine867163-17-5

Database identifiers

PubChem CID
53328624

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
69.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
247

Related reactions

19 records
New reaction record
HRID 17976 reaction equation
HRID 17976As reactantuspto-grants-2010_06
HRID 146807 reaction equation
HRID 146807As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 202170 reaction equation
HRID 202170As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 244126 reaction equation
HRID 244126As reactantuspto-grants-2014_02
HRID 244129 reaction equation
HRID 244129As reactantuspto-grants-2014_02
HRID 386203 reaction equation
HRID 386203As reactantuspto-grants-2013_02
HRID 386206 reaction equation
HRID 386206As reactantuspto-grants-2013_02
HRID 422639 reaction equation
HRID 422639As reactantuspto-grants-2012_01
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Compound notes

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