Basic information
- CAS
51093-88-0- Standard SMILES
c1ccc2c(c1)ncc1nc(-c3ccncc3)nnc12- InChIKey
MQGGKZCZWVKCLN-UHFFFAOYSA-N- Molecular formula
- C15H9N5
- Average molar mass
- 259.27 g/mol
- Monoisotopic mass
- 259.08579531
Names & identifiers
- Preferred name
- 2-Pyridin-4-yl-1,3,4,9-tetraaza-phenanthrene
- IUPAC
- 3-pyridin-4-yl-[1,2,4]triazino[5,6-c]quinoline
Names & synonyms
2-Pyridin-4-yl-1,3,4,9-tetraaza-phenanthrene51093-88-0DTXSID70199091RefChem:266535DTXCID00121582CHEMBL843033-(4-pyridyl)-[1,2,4]triazino[5,6-c]quinoline3-(Pyridin-4-yl)[1,2,4]triazino[5,6-c]quinoline
Database identifiers
- CAS
51093-88-0- PubChem CID
- 516638
- DTXSID
DTXSID70199091- ChEMBL
CHEMBL84303- Nikkaji
- J239.896F
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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