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Basic information
- Standard SMILES
CCC(c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl)N(C)C(C)=O- InChIKey
CSKKTGJSRCLUNE-UHFFFAOYSA-N- Molecular formula
- C22H23Cl3N4O
- Average molar mass
- 465.8 g/mol
- Monoisotopic mass
- 464.093744
Names & identifiers
- Preferred name
- N-{1-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]propyl}-N-methylacetamide
- IUPAC
- N-[1-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]propyl]-N-methylacetamide
Names & synonyms
SCHEMBL3760048CSKKTGJSRCLUNE-UHFFFAOYSA-NN-{1-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]propyl}-N-methylacetamide
Database identifiers
- PubChem CID
- 57786280
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 41.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 625
Related reactions
2 records
Compound notes
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