2-(4-((2-(3-Chlorophenyl)-6-ethylpyrimidin-4-yl)oxy)phenyl)ethanol
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Basic information
- Standard SMILES
CCc1cc(Oc2ccc(CCO)cc2)nc(-c2cccc(Cl)c2)n1- InChIKey
HCLCGWQIAMYHKR-UHFFFAOYSA-N- Molecular formula
- C20H19ClN2O2
- Average molar mass
- 354.8 g/mol
Names & identifiers
- Preferred name
- 2-(4-((2-(3-Chlorophenyl)-6-ethylpyrimidin-4-yl)oxy)phenyl)ethanol
- IUPAC
- 2-[4-[2-(3-chlorophenyl)-6-ethylpyrimidin-4-yl]oxyphenyl]ethanol
Names & synonyms
CHEMBL4449185SCHEMBL15661992HCLCGWQIAMYHKR-UHFFFAOYSA-NBDBM505250032-(4-((2-(3-Chlorophenyl)-6-ethylpyrimidin-4-yl)oxy)phenyl)ethanol
Database identifiers
- PubChem CID
- 90112840
- ChEMBL
CHEMBL4449185
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 55.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 390
Related reactions
1 records
Compound notes
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