2-[4-(1-Methyl-3-pyridin-4-yl-1H-pyrazol-4-yl)-phenoxymethyl]-quinoline
Basic information
- Standard SMILES
Cn1cc(-c2ccc(OCc3ccc4ccccc4n3)cc2)c(-c2ccncc2)n1- InChIKey
AESZYYCTKODVMP-UHFFFAOYSA-N- Molecular formula
- C25H20N4O
- Average molar mass
- 392.5 g/mol
Names & identifiers
- Preferred name
- 2-[4-(1-Methyl-3-pyridin-4-yl-1H-pyrazol-4-yl)-phenoxymethyl]-quinoline
- IUPAC
- 2-[[4-(1-methyl-3-pyridin-4-ylpyrazol-4-yl)phenoxy]methyl]quinoline
Names & synonyms
orb1699666SCHEMBL3271928SCHEMBL30123358AESZYYCTKODVMP-UHFFFAOYSA-NAKOS040749171T283632-[4-(1-Methyl-3-pyridin-4-yl-1H-pyrazol-4-yl)-phenoxymethyl]-quinoline2-[4-(1-Methyl-3-pyridin-4-yl-1H-pyrazol4-yl)-phenoxymethyl]-quinoline2-((4-(1-methyl-3-(pyridin-4-yl)-1H-pyrazol-4-yl)phenoxy)methyl)quinoline
Database identifiers
- PubChem CID
- 11610847
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 52.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 531
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Related reactions
2 records
Compound notes
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