Basic information
- Standard SMILES
C=C(OCC)c1cnc2nnn(Cc3ccc4ncccc4c3)c2n1- InChIKey
VILRUBMPTXMEIM-UHFFFAOYSA-N- Molecular formula
- C18H16N6O
- Average molar mass
- 332.4 g/mol
Names & identifiers
- Preferred name
- 6-[6-(1-Ethoxy-vinyl)[1,2,3]triazolo[4,5-b]pyrazin-1-ylmethyl]-quinoline
- IUPAC
- 6-[[5-(1-ethoxyethenyl)triazolo[4,5-b]pyrazin-3-yl]methyl]quinoline
Names & synonyms
SCHEMBL1163238VILRUBMPTXMEIM-UHFFFAOYSA-N6-((6-(1-Ethoxyvinyl)-1H-[1,2,3]triazolo[4,5-b]pyrazin-1-yl)methyl)quinoline6-[6-(1-ethoxy-vinyl)-[1,2,3]triazolo[4,5-b]pyrazin-1-ylmethyl]-quinoline6-[6-(1-ethoxy-vinyl)[1,2,3]triazolo[4,5-b]pyrazin-1-ylmethyl]-quinoline
Database identifiers
- PubChem CID
- 24851957
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 78.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 474
Related reactions
13 records
Linked notes
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