1-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]-N-(2,2,2-trifluoroethyl)propan-1-amine
Basic information
- Standard SMILES
CCC(NCC(F)(F)F)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl- InChIKey
BEDTTXLQSZSEDK-UHFFFAOYSA-N- Molecular formula
- C21H20Cl3F3N4
- Average molar mass
- 491.8 g/mol
- Monoisotopic mass
- 490.070564
Names & identifiers
- Preferred name
- 1-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]-N-(2,2,2-trifluoroethyl)propan-1-amine
- IUPAC
- 1-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]-N-(2,2,2-trifluoroethyl)propan-1-amine
Names & synonyms
1-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]-N-(2,2,2-trifluoroethyl)propan-1-amineSCHEMBL37588511-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahyropyrimido[1,2-a]benzimidazol-6-yl]-N-(2,2,2-trifluoroethyl)propan-1-amine
Database identifiers
- PubChem CID
- 57786118
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 613
Related reactions
2 records
Compound notes
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