Basic information
- Standard SMILES
COc1cc(S(=O)(=O)Cl)ccc1-c1nc2ncccc2[nH]1.Cl- InChIKey
KFQMBVQEZFALFQ-UHFFFAOYSA-N- Molecular formula
- C13H11Cl2N3O3S
- Average molar mass
- 360.2 g/mol
- Monoisotopic mass
- 358.9898178
Names & identifiers
- Preferred name
- 2-(2'-Methoxy-4'-chlorosulfonyl-phenyl)-imidazo[4,5-b]pyridine hydrochloride
- IUPAC
- 4-(1H-imidazo[4,5-b]pyridin-2-yl)-3-methoxybenzenesulfonyl chloride;hydrochloride
Names & synonyms
SCHEMBL10743612KFQMBVQEZFALFQ-UHFFFAOYSA-N2-(2'-Methoxy-4'-chlorosulfonyl-phenyl)-imidazo[4,5-b]pyridine hydrochloride
Database identifiers
- PubChem CID
- 20184517
Properties
Computed structural properties
- Topological polar surface area
- 93.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 470
Related reactions
2 records
Compound notes
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