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N-tert-butyl-2-(5-((6-methylpyridin-2-yl)ethynyl)thiophen-2-yl)imidazo[1,2-a]pyrazin-3-amine

HCID 69319611
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Basic information

Standard SMILES
Cc1cccc(C#Cc2ccc(-c3nc4cnccn4c3NC(C)(C)C)s2)n1
InChIKey
WHQLZVZFVASZGT-UHFFFAOYSA-N
Molecular formula
C22H21N5S
Average molar mass
387.5 g/mol

Names & identifiers

Preferred name
N-tert-butyl-2-(5-((6-methylpyridin-2-yl)ethynyl)thiophen-2-yl)imidazo[1,2-a]pyrazin-3-amine
IUPAC
N-tert-butyl-2-[5-[2-(6-methyl-2-pyridinyl)ethynyl]thiophen-2-yl]imidazo[1,2-a]pyrazin-3-amine

Names & synonyms

SCHEMBL5121895WHQLZVZFVASZGT-UHFFFAOYSA-NN-tert-butyl-2-(5-((6-methylpyridin-2-yl)ethynyl)thiophen-2-yl)imidazo[1,2-a]pyrazin-3-amine

Database identifiers

PubChem CID
69319611

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
83.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
28
Formal charge
0
Complexity
605

Related reactions

2 records
New reaction record
HRID 29112 reaction equation
HRID 29112As productuspto-grants-2008_09
HRID 1229721 reaction equation
HRID 1229721As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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