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2-(2-Tert-butyl-4-ethoxy-pyrimidin-5-yl)-4,5-bis-(4-chloro-phenyl)-4,5-dihydro-imidazole-1-carbonyl chloride

HCID 86613632
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCOc1nc(C(C)(C)C)ncc1C1=NC(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2)N1C(=O)Cl
InChIKey
LQXUEDWGQWCEHW-UHFFFAOYSA-N
Molecular formula
C26H25Cl3N4O2
Average molar mass
531.9 g/mol

Names & identifiers

Preferred name
2-(2-Tert-butyl-4-ethoxy-pyrimidin-5-yl)-4,5-bis-(4-chloro-phenyl)-4,5-dihydro-imidazole-1-carbonyl chloride
IUPAC
2-(2-tert-butyl-4-ethoxypyrimidin-5-yl)-4,5-bis(4-chlorophenyl)-4,5-dihydroimidazole-1-carbonyl chloride

Names & synonyms

LQXUEDWGQWCEHW-UHFFFAOYSA-N2-(2-tert-butyl-4-ethoxy-pyrimidin-5-yl)-4,5-bis-(4-chloro-phenyl)-4,5-dihydro-imidazole-1-carbonyl chloride

Database identifiers

PubChem CID
86613632

Properties

Computed structural properties

XLogP
7
Topological polar surface area
67.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
35
Formal charge
0
Complexity
760

Related reactions

10 records
New reaction record
HRID 645746 reaction equation
HRID 645746As productuspto-grants-2010_04
HRID 645747 reaction equation
HRID 645747As reactantuspto-grants-2010_04
HRID 645748 reaction equation
HRID 645748As reactantuspto-grants-2010_04
HRID 645749 reaction equation
HRID 645749As reactantuspto-grants-2010_04
HRID 645750 reaction equation
HRID 645750As reactantuspto-grants-2010_04
HRID 645751 reaction equation
HRID 645751As reactantuspto-grants-2010_04
HRID 645752 reaction equation
HRID 645752As reactantuspto-grants-2010_04
HRID 645753 reaction equation
HRID 645753As reactantuspto-grants-2010_04
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Compound notes

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