5-Chloro-2-pyridin-2-yl-1-(2-pyridin-4-ylethyl)benzimidazole
Basic information
- CAS
80477-81-2- Standard SMILES
Clc1ccc2c(c1)nc(-c1ccccn1)n2CCc1ccncc1- InChIKey
KDWNJVATKKGWPG-UHFFFAOYSA-N- Molecular formula
- C19H15ClN4
- Average molar mass
- 334.8 g/mol
- Monoisotopic mass
- 334.0985242
Names & identifiers
- Preferred name
- 5-Chloro-2-pyridin-2-yl-1-(2-pyridin-4-ylethyl)benzimidazole
- IUPAC
- 5-chloro-2-pyridin-2-yl-1-(2-pyridin-4-ylethyl)benzimidazole
Names & synonyms
NSC35678480477-81-2DTXSID90320249NSC-3567845-chloro-2-(2-pyridyl)-1-[2-(4-pyridyl)ethyl]benzimidazole1H-Benzimidazole, 5-chloro-2-(2-pyridinyl)-1-[2-(4-pyridinyl)ethyl]-5-Chloro-2-(pyridin-2-yl)-1-[2-(pyridin-4-yl)ethyl]-1H-1,3-benzimidazole
Database identifiers
- CAS
80477-81-2- PubChem CID
- 337746
- DTXSID
DTXSID90320249
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 43.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 401
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Related reactions
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Compound notes
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