7-(5-chloro-2-fluorophenyl)-3-((2-methyl-1,3-dioxolan-2-yl)methoxy)-5'H-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC1(COc2cnc3c(c2)C2(COC(N)=N2)c2cc(-c4cc(Cl)ccc4F)ccc2O3)OCCO1- InChIKey
ISKPJXBWAXCVNF-UHFFFAOYSA-N- Molecular formula
- C25H21ClFN3O5
- Average molar mass
- 497.9 g/mol
- Monoisotopic mass
- 497.1153766
Names & identifiers
- Preferred name
- 7-(5-chloro-2-fluorophenyl)-3-((2-methyl-1,3-dioxolan-2-yl)methoxy)-5'H-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine
- IUPAC
- 7'-(5-chloro-2-fluorophenyl)-3'-[(2-methyl-1,3-dioxolan-2-yl)methoxy]spiro[5H-1,3-oxazole-4,5'-chromeno[2,3-b]pyridine]-2-amine
Names & synonyms
SCHEMBL2371972ISKPJXBWAXCVNF-UHFFFAOYSA-N7-(5-chloro-2-fluorophenyl)-3-((2-methyl-1,3-dioxolan-2-yl)methoxy)-5'H-spiro[chromeno[2,3-b]pyridine-5,4'-oxazol]-2'-amine
Database identifiers
- PubChem CID
- 58466253
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 816
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Related reactions
1 records
Compound notes
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