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7-pyridin-3-yl-1H-pyrido[2,3-b][1,4]oxazin-2-one

HCID 66936747
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Basic information

Standard SMILES
O=C1COc2ncc(-c3cccnc3)cc2N1
InChIKey
AKUYKOWXAJHKMY-UHFFFAOYSA-N
Molecular formula
C12H9N3O2
Average molar mass
227.22 g/mol

Names & identifiers

Preferred name
7-pyridin-3-yl-1H-pyrido[2,3-b][1,4]oxazin-2-one
IUPAC
7-pyridin-3-yl-1H-pyrido[2,3-b][1,4]oxazin-2-one

Names & synonyms

SCHEMBL1191329AKUYKOWXAJHKMY-UHFFFAOYSA-N7-pyridin-3-yl-1H-pyrido[2,3-b][1,4]oxazin-2-one

Database identifiers

PubChem CID
66936747

Properties

Computed structural propertiesFilling in

XLogP
0.7
Topological polar surface area
64.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
17
Formal charge
0
Complexity
297

Related reactions

3 records
New reaction record
HRID 699948 reaction equation
HRID 699948As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1943703 reaction equation
HRID 1943703As productuspto-grants-2013_03
HRID 1943704 reaction equation
HRID 1943704As reactantuspto-grants-2013_03

Compound notes

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