Basic information
- Standard SMILES
COc1cc(-n2cc(C#Cc3ccnc(C)c3)nc2C)ccn1- InChIKey
IFORXOCKCLDCPO-UHFFFAOYSA-N- Molecular formula
- C18H16N4O
- Average molar mass
- 304.3 g/mol
- Monoisotopic mass
- 304.13241115
Names & identifiers
- Preferred name
- 2-Methoxy-4-[2-methyl-4-(2-methyl-pyridin-4-ylethynyl)-imidazol-1-yl]-pyridine
- IUPAC
- 2-methoxy-4-[2-methyl-4-[2-(2-methyl-4-pyridinyl)ethynyl]imidazol-1-yl]pyridine
Names & synonyms
SCHEMBL4629700IFORXOCKCLDCPO-UHFFFAOYSA-N2-Methoxy-4-[2-methyl-4-(2-methyl-pyridin-4-ylethynyl)-imidazol-1-yl]-pyridine
Database identifiers
- PubChem CID
- 10086375
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 456
Related reactions
2 records
Compound notes
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