3-(3-Cyclopentyloxy-4-methoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-carboxylic acid (3-nitro-4-fluoro-phenyl)-amide

HCID 57891771
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Basic information

Standard SMILES
COc1ccc(-c2cn(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)c3ncccc23)cc1OC1CCCC1
InChIKey
AWLBJZFJWILNBH-UHFFFAOYSA-N
Molecular formula
C26H23FN4O5
Average molar mass
490.5 g/mol

Names & identifiers

Preferred name
3-(3-Cyclopentyloxy-4-methoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-carboxylic acid (3-nitro-4-fluoro-phenyl)-amide
IUPAC
3-(3-cyclopentyloxy-4-methoxyphenyl)-N-(4-fluoro-3-nitrophenyl)pyrrolo[2,3-b]pyridine-1-carboxamide

Names & synonyms

SCHEMBL13666694AWLBJZFJWILNBH-UHFFFAOYSA-N3-(3-Cyclopentyloxy-4-methoxy-phenyl)-pyrrolo[2,3-b]pyridine-1-carboxylic acid (3-nitro-4-fluoro-phenyl)-amide

Database identifiers

PubChem CID
57891771

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
111 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
36

Related reactions

2 records
New reaction record

Compound notes

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