4-bromo-3-(1,2-dimethylindolin-6-yl)-1-methyl-1H-pyrrolo[2,3-b]pyridine

HCID 71114554
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1Cc2ccc(-c3cn(C)c4nccc(Br)c34)cc2N1C
InChIKey
PXWCDGAYUCOSKT-UHFFFAOYSA-N
Molecular formula
C18H18BrN3
Average molar mass
356.3 g/mol

Names & identifiers

Preferred name
4-bromo-3-(1,2-dimethylindolin-6-yl)-1-methyl-1H-pyrrolo[2,3-b]pyridine
IUPAC
4-bromo-3-(1,2-dimethyl-2,3-dihydroindol-6-yl)-1-methylpyrrolo[2,3-b]pyridine

Names & synonyms

SCHEMBL14243353PXWCDGAYUCOSKT-UHFFFAOYSA-N4-bromo-3-(1,2-dimethylindolin-6-yl)-1-methyl-1H-pyrrolo[2,3-b]pyridine

Database identifiers

PubChem CID
71114554

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
21.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
22

Related reactions

2 records
New reaction record

Compound notes

Loading…