1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-1-(phenylsulfonyl)-

HCID 59239753

Basic information

Standard SMILES
O=Cc1cn(S(=O)(=O)c2ccccc2)c2ncc(Br)cc12
InChIKey
KVKPWPOZFHWOQR-UHFFFAOYSA-N
Molecular formula
C14H9BrN2O3S
Average molar mass
365.2 g/mol

Names & identifiers

Preferred name
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-1-(phenylsulfonyl)-
IUPAC
1-(benzenesulfonyl)-5-bromopyrrolo[2,3-b]pyridine-3-carbaldehyde

Names & synonyms

799269-84-41H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 5-bromo-1-(phenylsulfonyl)-SCHEMBL4196067KVKPWPOZFHWOQR-UHFFFAOYSA-N1H-Pyrrolo[2,3-b]pyridine-3-carbaldehyde,5-bromo-1-(phenylsulfonyl)-DB-1136131-Benzenesulfonyl-5-bromo-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde

Database identifiers

PubChem CID
59239753

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
77.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
21

Related reactions

3 records

Compound notes

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