Basic information
- Standard SMILES
O=S(=O)(c1ccccc1)n1cc(-c2cc(Cl)nc(Cl)c2)c2cccnc21- InChIKey
UXESSAXQMBUKCZ-UHFFFAOYSA-N- Molecular formula
- C18H11Cl2N3O2S
- Average molar mass
- 404.3 g/mol
Names & identifiers
- Preferred name
- 3-(2,6-dichloropyridin-4-yl)-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
- IUPAC
- 1-(benzenesulfonyl)-3-(2,6-dichloro-4-pyridinyl)pyrrolo[2,3-b]pyridine
Names & synonyms
SCHEMBL1049986UXESSAXQMBUKCZ-UHFFFAOYSA-N3-(2,6-dichloropyridin-4-yl)-1-(phenyl sulfonyl)-1H-pyrrolo[2,3-b]pyridine3-(2,6-dichloropyridin-4-yl)-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine
Database identifiers
- PubChem CID
- 86649869
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 73.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 584
Related reactions
10 records
Compound notes
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