Basic information
- CAS
416891-72-0- Standard SMILES
CCn1c(C=C(OC(=O)c2ccc(Cl)cc2)c2ccc(Cl)cc2)nc2ccccc21- InChIKey
JGQAVFRMWTZCRH-UHFFFAOYSA-N- Molecular formula
- C24H18Cl2N2O2
- Average molar mass
- 437.3 g/mol
- Monoisotopic mass
- 436.0745332
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-2-(1-ethyl-1H-benzimidazol-2-yl)ethenyl 4-chlorobenzoate
- IUPAC
- [1-(4-chlorophenyl)-2-(1-ethylbenzimidazol-2-yl)ethenyl] 4-chlorobenzoate
Names & synonyms
DTXSID0011425321-(4-Chlorophenyl)-2-(1-ethyl-1H-benzimidazol-2-yl)ethenyl 4-chlorobenzoate416891-72-0
Database identifiers
- CAS
416891-72-0- PubChem CID
- 2850366
- DTXSID
DTXSID001142532
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 612
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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