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2-{4-[(4-fluorobenzyl)oxy]phenyl}-N-[1-(2-pyrrolidin-1-ylethyl)-1H-indazol-6-yl]acetamide

HCID 11213617
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(Cc1ccc(OCc2ccc(F)cc2)cc1)Nc1ccc2cnn(CCN3CCCC3)c2c1
InChIKey
DKLAXRMFKZZMMV-UHFFFAOYSA-N
Molecular formula
C28H29FN4O2
Average molar mass
472.6 g/mol

Names & identifiers

Preferred name
2-{4-[(4-fluorobenzyl)oxy]phenyl}-N-[1-(2-pyrrolidin-1-ylethyl)-1H-indazol-6-yl]acetamide
IUPAC
2-[4-[(4-fluorophenyl)methoxy]phenyl]-N-[1-(2-pyrrolidin-1-ylethyl)indazol-6-yl]acetamide

Names & synonyms

SCHEMBL6070085DKLAXRMFKZZMMV-UHFFFAOYSA-N2- {4-[(4-fluorobenzyl)oxy]phenyl}-N-[1-(2-pyrrolidin-1-ylethyl)-1H-indazol-6-yl]acetamide2-{4-[(4-fluorobenzyl)oxy]phenyl}-N-[1-(2-pyrrolidin-1-ylethyl)-1H-indazol-6-yl]acetamide

Database identifiers

PubChem CID
11213617

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
59.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
35
Formal charge
0
Complexity
659

Related reactions

2 records
New reaction record
HRID 693068 reaction equation
HRID 693068As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1790137 reaction equation
HRID 1790137As productuspto-grants-2006_07

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes