2-(3-Fluoro-phenyl)-pyrimidine-5-carboxylic acid 3-acetylsulfamoyl-benzylamide

HCID 16666100
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Basic information

Standard SMILES
CC(=O)NS(=O)(=O)c1cccc(CNC(=O)c2cnc(-c3cccc(F)c3)nc2)c1
InChIKey
MJOYMGYUFBZHCX-UHFFFAOYSA-N
Molecular formula
C20H17FN4O4S
Average molar mass
428.4 g/mol
Monoisotopic mass
428.09545437

Names & identifiers

Preferred name
2-(3-Fluoro-phenyl)-pyrimidine-5-carboxylic acid 3-acetylsulfamoyl-benzylamide
IUPAC
N-[[3-(acetylsulfamoyl)phenyl]methyl]-2-(3-fluorophenyl)pyrimidine-5-carboxamide

Names & synonyms

SCHEMBL4636627MJOYMGYUFBZHCX-UHFFFAOYSA-N2-(3-fluoro-phenyl)-pyrimidine-5-carboxylic acid 3-acetylsulfamoyl-benzylamide

Database identifiers

PubChem CID
16666100

Properties

Computed structural properties

XLogP
1.5
Topological polar surface area
127 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

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