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4-[[5-Ethoxycarbonyl-4-[4-fluoro-2-(methylidene-lambda3-bromanyl)phenyl]-2-(1-methyl-1,2,4-triazol-3-yl)-1,4-dihydropyrimidin-6-yl]methyl]morpholine-2-carboxylic acid

HCID 163961651
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
No structure available

Basic information

InChIKey
SHZTVYQRGKZRMX-UHFFFAOYSA-N
Molecular formula
C23H26BrFN6O5
Average molar mass
565.4 g/mol

Names & identifiers

Preferred name
4-[[5-Ethoxycarbonyl-4-[4-fluoro-2-(methylidene-lambda3-bromanyl)phenyl]-2-(1-methyl-1,2,4-triazol-3-yl)-1,4-dihydropyrimidin-6-yl]methyl]morpholine-2-carboxylic acid
IUPAC
4-[[5-ethoxycarbonyl-4-[4-fluoro-2-(methylidene-λ3-bromanyl)phenyl]-2-(1-methyl-1,2,4-triazol-3-yl)-1,4-dihydropyrimidin-6-yl]methyl]morpholine-2-carboxylic acid

Database identifiers

PubChem CID
163961651

Properties

Computed structural propertiesFilling in

XLogP
-0.5
Topological polar surface area
131 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
9
Heavy atoms
36
Formal charge
0
Complexity
919

Related reactions

0 records
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Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes