5-nitro-2-(pyridin-2-yl)-1-(2-(pyridin-4-yl) ethyl)-1H-benzo[d]imidazole
Basic information
- CAS
80477-85-6- Standard SMILES
O=[N+]([O-])c1ccc2c(c1)nc(-c1ccccn1)n2CCc1ccncc1- InChIKey
DPWNICJBRRYQIR-UHFFFAOYSA-N- Molecular formula
- C19H15N5O2
- Average molar mass
- 345.4 g/mol
- Monoisotopic mass
- 345.12257474
Names & identifiers
- Preferred name
- 5-nitro-2-(pyridin-2-yl)-1-(2-(pyridin-4-yl) ethyl)-1H-benzo[d]imidazole
- IUPAC
- 5-nitro-2-pyridin-2-yl-1-(2-pyridin-4-ylethyl)benzimidazole
Names & synonyms
NSC-356781NSC356781CHEMBL52323280477-85-6DTXSID10320246BDBM502654635-nitro-2-(pyridin-2-yl)-1-(2-(pyridin-4-yl) ethyl)-1H-benzo[d]imidazole5-nitro-2-(2-pyridyl)-1-[2-(4-pyridyl)ethyl]benzimidazole5-Nitro-2-pyridin-2-yl-1-(2-pyridin-4-yl-ethyl)-1H-benzoimidazole5-nitro-2-(pyridin-2-yl)-1-(2-(pyridin-4-yl)ethyl)-1H-benzo[d]imidazole5-Nitro-2-(pyridin-2-yl)-1-[2-(pyridin-4-yl)ethyl]-1H-1,3-benzimidazole
Database identifiers
- CAS
80477-85-6- PubChem CID
- 337743
- DTXSID
DTXSID10320246- ChEMBL
CHEMBL523232
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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