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2-[4-(2-fluorophenyl)phenyl]-N-methyl-N-(4-methyl-5-sulfamoyl-thiazol-2-yl)acetamide

HCID 504302
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1nc(N(C)C(=O)Cc2ccc(-c3ccccc3F)cc2)sc1S(N)(=O)=O
InChIKey
IAGBPTKVLHJTBL-UHFFFAOYSA-N
Molecular formula
C19H18FN3O3S2
Average molar mass
419.5 g/mol

Names & identifiers

Preferred name
2-[4-(2-fluorophenyl)phenyl]-N-methyl-N-(4-methyl-5-sulfamoyl-thiazol-2-yl)acetamide
IUPAC
2-[4-(2-fluorophenyl)phenyl]-N-methyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide

Names & synonyms

SCHEMBL1177266CHEMBL4071722IAGBPTKVLHJTBL-UHFFFAOYSA-N2-[4-(2-fluorophenyl)phenyl]-N-methyl-N-(4-methyl-5-sulfamoyl-thiazol-2-yl)acetamideN-[5-(Aminosulfonyl)-4-methyl-1,3-thiazol-2-yl]-2-(2'-fluoro[1,1'-biphenyl]-4-yl)-N-methylacetamideN-[5-(Aminosulfonyl)-4-methyl-1,3-thiazol-2-yl]-2-(2'-fluorobiphenyl-4-yl)-N-methylacetamideN-[5-(Aminosulphonyl)-4-methyl-1,3-thiazol-2-yl]-2-(2'-fluoro[1,1'-biphenyl]-4-yl)-N-methylacetamide

Database identifiers

PubChem CID
504302
ChEMBL
CHEMBL4071722

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
130 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
28
Formal charge
0
Complexity
649

Related reactions

3 records
New reaction record
HRID 116384 reaction equation
HRID 116384As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1362786 reaction equation
HRID 1362786As productuspto-grants-2011_02
HRID 2213532 reaction equation
HRID 2213532As productuspto-grants-2006_09

Compound notes

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