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Basic information
- Standard SMILES
CCC(NC(C)=O)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl- InChIKey
LKTBXHFUMZGQIS-UHFFFAOYSA-N- Molecular formula
- C21H21Cl3N4O
- Average molar mass
- 451.8 g/mol
Names & identifiers
- Preferred name
- N-{1-[9-chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]propyl}acetamide
- IUPAC
- N-[1-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]propyl]acetamide
Names & synonyms
SCHEMBL3752457LKTBXHFUMZGQIS-UHFFFAOYSA-NN-{1-[9-chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]propyl}acetamide
Database identifiers
- PubChem CID
- 57786336
Properties
Computed structural propertiesFilling in
- XLogP
- 5.4
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 596
Related reactions
3 records
Compound notes
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