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Ethyl 4-tert-Butyl-2-((2-methyl-3-(4-methyl-6-(4-(morpholine-4-carbonyl)phenyl amino)-5-oxo-4,5-dihydropyrazin-2yl)phenylamino)methyl)benzoate

HCID 66610366
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Basic information

Standard SMILES
CCOC(=O)c1ccc(C(C)(C)C)cc1CNc1cccc(-c2cn(C)c(=O)c(Nc3ccc(C(=O)N4CCOCC4)cc3)n2)c1C
InChIKey
ZDALHYSLORHVKW-UHFFFAOYSA-N
Molecular formula
C37H43N5O5
Average molar mass
637.8 g/mol
Monoisotopic mass
637.32641949

Names & identifiers

Preferred name
Ethyl 4-tert-Butyl-2-((2-methyl-3-(4-methyl-6-(4-(morpholine-4-carbonyl)phenyl amino)-5-oxo-4,5-dihydropyrazin-2yl)phenylamino)methyl)benzoate
IUPAC
ethyl 4-tert-butyl-2-[[2-methyl-3-[4-methyl-6-[4-(morpholine-4-carbonyl)anilino]-5-oxopyrazin-2-yl]anilino]methyl]benzoate

Names & synonyms

SCHEMBL163069ZDALHYSLORHVKW-UHFFFAOYSA-NEthyl 4-tert-Butyl-2-((2-methyl-3-(4-methyl-6-(4-(morpholine-4-carbonyl)phenyl amino)-5-oxo-4,5-dihydropyrazin-2yl)phenylamino)methyl)benzoate

Database identifiers

PubChem CID
66610366

Properties

Computed structural propertiesFilling in

XLogP
5.3
Topological polar surface area
113 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
11
Heavy atoms
47
Formal charge
0
Complexity
1,170

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Related reactions

2 records
New reaction record
HRID 1772071 reaction equation
HRID 1772071As productuspto-grants-2016_02
HRID 1772072 reaction equation
HRID 1772072As reactantuspto-grants-2016_02

Compound notes

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