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1-(3-Fluoro5-(4-methyl-3-pyridyl)phenylcarbamoyl)-5-methoxy-6-trifluoromethylindoline

HCID 18005152
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Basic information

Standard SMILES
COc1cc2c(cc1C(F)(F)F)N(C(=O)Nc1cc(F)cc(-c3cnccc3C)c1)CC2
InChIKey
IZSOZODCXKOLMC-UHFFFAOYSA-N
Molecular formula
C23H19F4N3O2
Average molar mass
445.4 g/mol

Names & identifiers

Preferred name
1-(3-Fluoro5-(4-methyl-3-pyridyl)phenylcarbamoyl)-5-methoxy-6-trifluoromethylindoline
IUPAC
N-[3-fluoro-5-(4-methyl-3-pyridinyl)phenyl]-5-methoxy-6-(trifluoromethyl)-2,3-dihydroindole-1-carboxamide

Names & synonyms

1-(3-Fluoro5-(4-methyl-3-pyridyl)phenylcarbamoyl)-5-methoxy-6-trifluoromethylindolineSCHEMBL7041608L0153661-(3-Fluoro-5-(4-methyl-3-pyridyl)phenylcarbamoyl)-5-methoxy-6-trifluoromethylindoline

Database identifiers

PubChem CID
18005152

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
54.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
32
Formal charge
0
Complexity
664

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Related reactions

4 records
New reaction record
HRID 989199 reaction equation
HRID 989199As productuspto-grants-2003_10
HRID 1124960 reaction equation
HRID 1124960As productTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1603787 reaction equation
HRID 1603787As productuspto-grants-1999_11
HRID 1977761 reaction equation
HRID 1977761As productuspto-grants-2001_05

Compound notes

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