3-Pyridin-2-yl-pyrido[3,4-e][1,2,4]triazine

HCID 516615

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Basic information

CAS: 121845-65-6
Standard SMILES: c1ccc(-c2nnc3ccncc3n2)nc1
InChIKey: UWOUQHOBPISZHS-UHFFFAOYSA-N
Molecular formula: C11H7N5
Average molar mass: 209.21 g/mol
Monoisotopic mass: 209.07014524

Names & identifiers

Preferred name: 3-Pyridin-2-yl-pyrido[3,4-e][1,2,4]triazine
IUPAC: 3-pyridin-2-ylpyrido[3,4-e][1,2,4]triazine

Names & synonyms

121845-65-63-Pyridin-2-yl-pyrido[3,4-e][1,2,4]triazine3-(Pyridin-2-yl)pyrido[3,4-e][1,2,4]triazine3-Pyridin-2-yl-pyrido(3,4-e)(1,2,4)triazine3-pyridin-2-ylpyrido[3,4-e][1,2,4]triazineCHEMBL310635DTXSID801534023-(2-pyridyl)pyrido[3,4-e][1,2,4]triazine

Database identifiers

CAS: 121845-65-6
PubChem CID: 516615
DTXSID: DTXSID80153402
ChEMBL: CHEMBL310635
Nikkaji: J239.924E

Properties

Computed structural properties

XLogP: 0.2
Topological polar surface area: 64.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 16
Formal charge: 0
Complexity: 234

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