Basic information
- Standard SMILES
CCOc1ccc(-c2nc(-c3ccncc3)co2)cc1OCC- InChIKey
XDSKRNQJAXVFMH-UHFFFAOYSA-N- Molecular formula
- C18H18N2O3
- Average molar mass
- 310.3 g/mol
Names & identifiers
- Preferred name
- 2-(3,4-Diethoxyphenyl)-4-(pyridin-4-yl)oxazole
- IUPAC
- 2-(3,4-diethoxyphenyl)-4-pyridin-4-yl-1,3-oxazole
Names & synonyms
SCHEMBL1402313XDSKRNQJAXVFMH-UHFFFAOYSA-N2-(3,4-diethoxyphenyl)-4-(pyridin-4-yl)oxazole
Database identifiers
- PubChem CID
- 59145490
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 349
Related reactions
5 records
Compound notes
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