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Basic information
- Standard SMILES
Nc1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl- InChIKey
JZRIOIHWNLJODD-UHFFFAOYSA-N- Molecular formula
- C16H13Cl3N4
- Average molar mass
- 367.7 g/mol
- Monoisotopic mass
- 366.02058
Names & identifiers
- Preferred name
- 9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-amine
- IUPAC
- 9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-amine
Names & synonyms
SCHEMBL3752879JZRIOIHWNLJODD-UHFFFAOYSA-N9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-amine
Database identifiers
- PubChem CID
- 57786328
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 47.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 440
Related reactions
8 records
Compound notes
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