Basic information
- Standard SMILES
CCOc1nc(SC)ncc1C1=NC(c2ccc(Cl)cc2)C(c2ccc(Cl)cc2)N1- InChIKey
OLWRUQSLMFKHAW-UHFFFAOYSA-N- Molecular formula
- C22H20Cl2N4OS
- Average molar mass
- 459.4 g/mol
Names & identifiers
- Preferred name
- 4,5-bis-(4-chloro-phenyl)-2-(4-ethoxy-2-methylsulfanyl-pyrimidin-5-yl)-4,5-dihydro-1H-imidazole
- IUPAC
- 5-[4,5-bis(4-chlorophenyl)-4,5-dihydro-1H-imidazol-2-yl]-4-ethoxy-2-methylsulfanylpyrimidine
Names & synonyms
OLWRUQSLMFKHAW-UHFFFAOYSA-N4,5-bis-(4-chloro-phenyl)-2-(4-ethoxy-2-methylsulfanyl-pyrimidin-5-yl)-4,5-dihydro-1H-imidazole
Database identifiers
- PubChem CID
- 86613629
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 84.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 581
Related reactions
1 records
Compound notes
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