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N9-(3,5-dichloro-4-pyridyl)-6-difluoromethoxybenzo[4,5]furo[3,2-c]pyridine-9-carboxamide

HCID 11546334
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(Nc1c(Cl)cncc1Cl)c1ccc(OC(F)F)c2oc3ccncc3c12
InChIKey
NZAJCVXXUVCFAY-UHFFFAOYSA-N
Molecular formula
C18H9Cl2F2N3O3
Average molar mass
424.2 g/mol

Names & identifiers

Preferred name
N9-(3,5-dichloro-4-pyridyl)-6-difluoromethoxybenzo[4,5]furo[3,2-c]pyridine-9-carboxamide
IUPAC
N-(3,5-dichloro-4-pyridinyl)-6-(difluoromethoxy)-[1]benzofuro[3,2-c]pyridine-9-carboxamide

Names & synonyms

N9-(3,5-dichloro-4-pyridyl)-6-difluoromethoxybenzo[4,5]furo[3,2-c]pyridine-9-carboxamideSCHEMBL72937

Database identifiers

PubChem CID
11546334

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
77.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
28
Formal charge
0
Complexity
566

Related reactions

2 records
New reaction record
HRID 164197 reaction equation
HRID 164197As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1091870 reaction equation
HRID 1091870As productuspto-grants-2012_03

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes