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2-(4-Cyclopropanesulfonyl-phenyl)-2-(2,4-difluoro-phenoxy)-N-(5-methoxy-thiazol-2-yl)-acetamide

HCID 59610065
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cnc(NC(=O)C(Oc2ccc(F)cc2F)c2ccc(S(=O)(=O)C3CC3)cc2)s1
InChIKey
BRYJJLOZVYWZTP-UHFFFAOYSA-N
Molecular formula
C21H18F2N2O5S2
Average molar mass
480.5 g/mol

Names & identifiers

Preferred name
2-(4-Cyclopropanesulfonyl-phenyl)-2-(2,4-difluoro-phenoxy)-N-(5-methoxy-thiazol-2-yl)-acetamide
IUPAC
2-(4-cyclopropylsulfonylphenyl)-2-(2,4-difluorophenoxy)-N-(5-methoxy-1,3-thiazol-2-yl)acetamide

Names & synonyms

SCHEMBL3764624BRYJJLOZVYWZTP-UHFFFAOYSA-N2-(4-Cyclopropanesulfonyl-phenyl)-2-(2,4-difluoro-phenoxy)-N-(5-methoxy-thiazol-2-yl)-acetamide

Database identifiers

PubChem CID
59610065

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
131 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
8
Heavy atoms
32
Formal charge
0
Complexity
756

Related reactions

2 records
New reaction record
HRID 1560977 reaction equation
HRID 1560977As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1889193 reaction equation
HRID 1889193As productuspto-grants-2013_08

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes