Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCC(CC(C)=O)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl- InChIKey
FRZNYBRPZKCHQD-UHFFFAOYSA-N- Molecular formula
- C22H22Cl3N3O
- Average molar mass
- 450.8 g/mol
Names & identifiers
- Preferred name
- 4-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]hexan-2-one
- IUPAC
- 4-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]hexan-2-one
Names & synonyms
SCHEMBL3764133FRZNYBRPZKCHQD-UHFFFAOYSA-N4-[9-Chloro-1-(2,4-dichlorophenyl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl]hexan-2-one
Database identifiers
- PubChem CID
- 57786274
Properties
Computed structural propertiesFilling in
- XLogP
- 6.2
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 594
Related reactions
2 records
Compound notes
Loading…