1-[(6-Chloropyridin-3-yl)methyl]-1H-benzimidazole
Basic information
- CAS
919114-61-7- Standard SMILES
Clc1ccc(Cn2cnc3ccccc32)cn1- InChIKey
GQEXMWSXZZDMTL-UHFFFAOYSA-N- Molecular formula
- C13H10ClN3
- Average molar mass
- 243.69 g/mol
- Monoisotopic mass
- 243.056325
Names & identifiers
- Preferred name
- 1-[(6-Chloropyridin-3-yl)methyl]-1H-benzimidazole
- IUPAC
- 1-[(6-chloro-3-pyridinyl)methyl]benzimidazole
Names & synonyms
919114-61-71-[(6-Chloropyridin-3-yl)methyl]-1H-benzimidazole1-[(6-chloropyridin-3-yl)methyl]benzimidazoleDTXSID40602744AKOS0001581811-(6-Chloropyridin-3-ylmethyl)-1H-benzoimidazole1-((6-chloropyridin-3-yl)methyl)-1h-benzo[d]imidazole1-[(6-Chloropyridin-3-yl)methyl]-1H-1,3-benzimidazoleZ281877170
Database identifiers
- CAS
919114-61-7- PubChem CID
- 20120533
- DTXSID
DTXSID40602744
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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