(S)-N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-cyano-3-fluorophenoxy)-2-hydroxy-2-methylpropanamide

HCID 16045149

Notes Reactions

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Basic information

Standard SMILES: C[C@](O)(COc1ccc(C#N)c(F)c1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1
InChIKey: JQFMUAOGKUMGNM-SFHVURJKSA-N
Molecular formula: C19H13F4N3O3
Average molar mass: 407.3 g/mol

Names & identifiers

Preferred name: (S)-N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-cyano-3-fluorophenoxy)-2-hydroxy-2-methylpropanamide
IUPAC: (2S)-3-(4-cyano-3-fluorophenoxy)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-2-methylpropanamide

Names & synonyms

(S)-N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-cyano-3-fluorophenoxy)-2-hydroxy-2-methylpropanamideSCHEMBL2189551SCHEMBL29850810

Database identifiers

PubChem CID: 16045149

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 106 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 9
Rotatable bonds: 5
Heavy atoms: 29
Formal charge: 0
Complexity: 698

Related reactions

7 records

New reaction record

HRID 83111As productuspto-grants-2014_09

HRID 659819As productuspto-grants-2011_12

HRID 922106As productuspto-grants-2016_03

HRID 1184799As productuspto-grants-2014_03

HRID 1631189As productuspto-grants-2014_07

HRID 1876479As productuspto-grants-2012_11

HRID 1969166As productuspto-grants-2013_04

Compound notes

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