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N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-[4-(trifluoromethyl)phenyl]propan-2-yl]-2-methoxyacetamide

HCID 91601351
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COCC(=O)NC(C)C(Oc1ccc2c(cnn2-c2ccc(F)cc2)c1)c1ccc(C(F)(F)F)cc1
InChIKey
USVDDASFSHKANS-UHFFFAOYSA-N
Molecular formula
C26H23F4N3O3
Average molar mass
501.5 g/mol
Monoisotopic mass
501.16755425

Names & identifiers

Preferred name
N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-[4-(trifluoromethyl)phenyl]propan-2-yl]-2-methoxyacetamide
IUPAC
N-[1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-[4-(trifluoromethyl)phenyl]propan-2-yl]-2-methoxyacetamide

Database identifiers

PubChem CID
91601351

Properties

Computed structural propertiesFilling in

XLogP
5.3
Topological polar surface area
65.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
36
Formal charge
0
Complexity
711

Related reactions

1 records
New reaction record
HRID 1571952 reaction equation
HRID 1571952As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes