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5-(8-Morpholino-2-((quinolin-2-yloxy)methyl)imidazo[1,2-a]pyrazin-5-yl)pyridine-2-sulfonamide trifluoroacetic acid salt

HCID 86345643
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
NS(=O)(=O)c1ccc(-c2cnc(N3CCOCC3)c3nc(COc4ccc5ccccc5n4)cn23)cn1.O=C(O)C(F)(F)F
InChIKey
IXWPAURGYOZSCT-UHFFFAOYSA-N
Molecular formula
C27H24F3N7O6S
Average molar mass
631.6 g/mol
Monoisotopic mass
631.14608717

Names & identifiers

Preferred name
5-(8-Morpholino-2-((quinolin-2-yloxy)methyl)imidazo[1,2-a]pyrazin-5-yl)pyridine-2-sulfonamide trifluoroacetic acid salt
IUPAC
5-[8-morpholin-4-yl-2-(quinolin-2-yloxymethyl)imidazo[1,2-a]pyrazin-5-yl]pyridine-2-sulfonamide;2,2,2-trifluoroacetic acid

Names & synonyms

5-(8-Morpholino-2-((quinolin-2-yloxy)methyl)imidazo[1,2-a]pyrazin-5-yl)pyridine-2-sulfonamide trifluoroacetic acid saltSCHEMBL16277913

Database identifiers

PubChem CID
86345643

Properties

Computed structural propertiesFilling in

Topological polar surface area
184 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
15
Rotatable bonds
6
Heavy atoms
44
Formal charge
0
Complexity
953

Related reactions

1 records
New reaction record
HRID 1772662 reaction equation
HRID 1772662As productuspto-grants-2016_02

Compound notes

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