9-Chloro-1-(2,4-dichlorophenyl)-6-(2,2,2-trifluoro-1-methoxyethyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole
Basic information
- Standard SMILES
COC(c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl)C(F)(F)F- InChIKey
CEMXHIRNHSSYFS-UHFFFAOYSA-N- Molecular formula
- C19H15Cl3F3N3O
- Average molar mass
- 464.7 g/mol
- Monoisotopic mass
- 463.02328
Names & identifiers
- Preferred name
- 9-Chloro-1-(2,4-dichlorophenyl)-6-(2,2,2-trifluoro-1-methoxyethyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole
- IUPAC
- 9-chloro-1-(2,4-dichlorophenyl)-6-(2,2,2-trifluoro-1-methoxyethyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole
Names & synonyms
9-Chloro-1-(2,4-dichlorophenyl)-6-(2,2,2-trifluoro-1-methoxyethyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazoleSCHEMBL3759189
Database identifiers
- PubChem CID
- 57786266
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 30.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 587
Related reactions
2 records
Compound notes
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