Basic information
- Standard SMILES
CCSCc1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl- InChIKey
XJOXJOWWEHZAFL-UHFFFAOYSA-N- Molecular formula
- C19H18Cl3N3S
- Average molar mass
- 426.8 g/mol
Names & identifiers
- Preferred name
- 9-Chloro-1-(2,4-dichlorophenyl)-6-[(ethylsulfanyl)methyl]-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole
- IUPAC
- 9-chloro-1-(2,4-dichlorophenyl)-6-(ethylsulfanylmethyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole
Names & synonyms
SCHEMBL3758989XJOXJOWWEHZAFL-UHFFFAOYSA-N9-Chloro-1-(2,4-dichlorophenyl)-6-[(ethylsulfanyl)methyl]-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole
Database identifiers
- PubChem CID
- 57786375
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 46.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 485
Related reactions
4 records
Compound notes
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