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N-[1-[1-(4-chlorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-2,2-difluoropropanamide

HCID 72258598
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cccc(C(Oc2ccc3c(cnn3-c3ccc(Cl)cc3)c2)C(C)NC(=O)C(C)(F)F)c1
InChIKey
XQQUQHOFFVJFOO-UHFFFAOYSA-N
Molecular formula
C26H24ClF2N3O3
Average molar mass
499.9 g/mol
Monoisotopic mass
499.1474257

Names & identifiers

Preferred name
N-[1-[1-(4-chlorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-2,2-difluoropropanamide
IUPAC
N-[1-[1-(4-chlorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-2,2-difluoropropanamide

Database identifiers

PubChem CID
72258598

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
65.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
35
Formal charge
0
Complexity
709

Related reactions

1 records
New reaction record
HRID 938098 reaction equation
HRID 938098As productValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes