Basic information
- CAS
56291-49-7- Standard SMILES
Brc1cnc2nc(Cc3ccccc3)[nH]c2c1- InChIKey
YDXTWQDOSWIRTC-UHFFFAOYSA-N- Molecular formula
- C13H10BrN3
- Average molar mass
- 288.14 g/mol
- Monoisotopic mass
- 287.00581
Names & identifiers
- Preferred name
- 2-benzyl-6-bromo-1H-imidazo[4,5-b]pyridine
- IUPAC
- 2-benzyl-6-bromo-1H-imidazo[4,5-b]pyridine
Names & synonyms
56291-49-72-benzyl-6-bromo-1H-imidazo[4,5-b]pyridineNSC381506SCHEMBL4060448SCHEMBL13607779DTXSID90321791YDXTWQDOSWIRTC-UHFFFAOYSA-NAKOS010941372NSC-381506DS-0048502-benzyl-6-bromo-3H-imidazo[4,5-b]pyridine3H-IMIDAZO[4,5-B]PYRIDINE,6-BROMO-2-(PHENYLMETHYL)-
Database identifiers
- CAS
56291-49-7- PubChem CID
- 342995
- DTXSID
DTXSID90321791
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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