Basic information
- Standard SMILES
CC(Oc1ncc(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)n1)c1ccc(F)cc1- InChIKey
PUSAVGVGYWFURH-UHFFFAOYSA-N- Molecular formula
- C24H16Cl3FN2O
- Average molar mass
- 473.7 g/mol
- Monoisotopic mass
- 472.031224
Names & identifiers
- Preferred name
- 2-(alpha-Methyl-4-fluorobenzyloxy-)-4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)pyrimidine
- IUPAC
- 4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-[1-(4-fluorophenyl)ethoxy]pyrimidine
Names & synonyms
SCHEMBL4807597PUSAVGVGYWFURH-UHFFFAOYSA-N2-(alpha-methyl-4-fluorobenzyloxy-)-4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)pyrimidine
Database identifiers
- PubChem CID
- 10344804
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 557
Related reactions
1 records
Compound notes
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