Quinoline, 2-((1H-imidazo(4,5-b)pyridin-2-ylsulfinyl)methyl)-
Basic information
- CAS
123823-92-7- Standard SMILES
O=S(Cc1ccc2ccccc2n1)c1nc2ncccc2[nH]1- InChIKey
DVBJGGOFMSJLBY-UHFFFAOYSA-N- Molecular formula
- C16H12N4OS
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.07318219
Names & identifiers
- Preferred name
- Quinoline, 2-((1H-imidazo(4,5-b)pyridin-2-ylsulfinyl)methyl)-
- IUPAC
- 2-(1H-imidazo[4,5-b]pyridin-2-ylsulfinylmethyl)quinoline
Names & synonyms
Quinoline, 2-((1H-imidazo(4,5-b)pyridin-2-ylsulfinyl)methyl)-2-(2'-Quinolylmethylsulfinyl)imidazo(4,5-b)pyridine123823-92-72-((1H-Imidazo(4,5-b)pyridin-2-ylsulfinyl)methyl)quinolineRefChem:378502DTXSID709246082-[(3H-Imidazo[4,5-b]pyridine-2-sulfinyl)methyl]quinoline
Database identifiers
- CAS
123823-92-7- PubChem CID
- 3078992
- DTXSID
DTXSID70924608
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 421
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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