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N-[4-(N,N-Diethylaminosulfonyl)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide

HCID 9799392
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCN(CC)S(=O)(=O)c1ccc(NC(=O)C(C)(O)C(F)(F)F)cc1
InChIKey
DYMOQRBZQBQYDN-UHFFFAOYSA-N
Molecular formula
C14H19F3N2O4S
Average molar mass
368.37 g/mol

Names & identifiers

Preferred name
N-[4-(N,N-Diethylaminosulfonyl)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide
IUPAC
N-[4-(diethylsulfamoyl)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamide

Names & synonyms

N-[4-(N,N-Diethylaminosulfonyl)phenyl]-3,3,3-trifluoro-2-hydroxy-2-methylpropanamideCHEMBL168073SCHEMBL8488473

Database identifiers

PubChem CID
9799392
ChEMBL
CHEMBL168073

Properties

Computed structural propertiesFilling in

XLogP
1.7
Topological polar surface area
95.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
24
Formal charge
0
Complexity
535

Related reactions

2 records
New reaction record
HRID 932442 reaction equation
HRID 932442As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1938171 reaction equation
HRID 1938171As productuspto-grants-1997_12

Compound notes

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