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Basic information
- Standard SMILES
CCC(OCC(F)(F)F)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(N(C)C)nc1C- InChIKey
RNFPANCQFPXRJU-UHFFFAOYSA-N- Molecular formula
- C23H27ClF3N5O
- Average molar mass
- 481.9 g/mol
- Monoisotopic mass
- 481.1856227
Names & identifiers
- Preferred name
- 5-{9-Chloro-6-[1-(2,2,2-trifluoroethoxy)propyl]-3,4-dihydropyrimido[1,2-a]benzimidazol-1(2H)-yl}-N,N,6-trimethylpyridin-2-amine
- IUPAC
- 5-[9-chloro-6-[1-(2,2,2-trifluoroethoxy)propyl]-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-1-yl]-N,N,6-trimethylpyridin-2-amine
Names & synonyms
5-{9-Chloro-6-[1-(2,2,2-trifluoroethoxy)propyl]-3,4-dihydropyrimido[1,2-a]benzimidazol-1(2H)-yl}-N,N,6-trimethylpyridin-2-amineSCHEMBL3759069
Database identifiers
- PubChem CID
- 57786110
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 46.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 656
Related reactions
2 records
Compound notes
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