8-fluoro-7-(2-fluoropyridin-3-yl)-3-((3-methyloxetan-3-yl)ethynyl)-5'H-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine

HCID 58466286

Notes Reactions

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Basic information

Standard SMILES: CC1(C#Cc2cnc3c(c2)C2(COC(N)=N2)c2cc(-c4cccnc4F)c(F)cc2O3)COC1
InChIKey: VILCWPRJSJVTCR-UHFFFAOYSA-N
Molecular formula: C25H18F2N4O3
Average molar mass: 460.4 g/mol

Names & identifiers

Preferred name: 8-fluoro-7-(2-fluoropyridin-3-yl)-3-((3-methyloxetan-3-yl)ethynyl)-5'H-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine
IUPAC: 8'-fluoro-7'-(2-fluoro-3-pyridinyl)-3'-[2-(3-methyloxetan-3-yl)ethynyl]spiro[5H-1,3-oxazole-4,5'-chromeno[2,3-b]pyridine]-2-amine

Names & synonyms

SCHEMBL2371513VILCWPRJSJVTCR-UHFFFAOYSA-N8-fluoro-7-(2-fluoropyridin-3-yl)-3-((3-methyloxetan-3-yl)ethynyl)-5'H-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine

Database identifiers

PubChem CID: 58466286

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 91.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 3
Heavy atoms: 34
Formal charge: 0
Complexity: 901

Related reactions

1 records

New reaction record

HRID 335875As productuspto-grants-2014_11

Compound notes

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