2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide

C16H16F2N2O3S — CID 38352115

IUPAC2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-2-9-19-24(22,23)13-6-4-12(5-7-13)20-16(21)14-8-3-11(17)10-15(14)18/h3-8,10,19H,2,9H2,1H3,(H,20,21)
InChIKeyKLLXXNSTKFCYCJ-UHFFFAOYSA-N
MW354.38 g/mol
LogP2.91
Rot. Bonds6

About 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide

2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide (PubChem CID 38352115) has the molecular formula C16H16F2N2O3S and a molecular weight of 354.38 g/mol. Its IUPAC name is 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide
PubChem CID38352115
Molecular FormulaC16H16F2N2O3S
Molecular Weight354.38 g/mol
Exact Mass354.08
IUPAC Name2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide
SMILESCCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2F)cc1
InChIInChI=1S/C16H16F2N2O3S/c1-2-9-19-24(22,23)13-6-4-12(5-7-13)20-16(21)14-8-3-11(17)10-15(14)18/h3-8,10,19H,2,9H2,1H3,(H,20,21)
InChIKeyKLLXXNSTKFCYCJ-UHFFFAOYSA-N
XLogP2.91
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.38
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dichloro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 4778992
2,5-dichloro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17320181
2,4-dimethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 38352261
2,6-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17146819
2-fluoro-N-(3-fluoro-4-methylphenyl)-5-(propylsulfamoyl)benzamide
CID 25038796
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2,4-difluorobenzamide
CID 24636502
N-(4-butylphenyl)-2,4-difluorobenzamide
CID 8961049
4-ethyl-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17108469
5-bromo-2-methoxy-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 17094279
2-(difluoromethoxy)-N-[4-(propylsulfamoyl)phenyl]benzamide
CID 34174804
N-[4-(propylsulfamoyl)phenyl]-2-propylsulfonylbenzamide
CID 17225015
2,4-difluoro-N-(4-propoxyphenyl)benzamide
CID 17178087

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide (CID 38352115) is 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide is CCCNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2F)cc1.
What is the InChIKey of 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide?
The InChIKey is KLLXXNSTKFCYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2N2O3S/c1-2-9-19-24(22,23)13-6-4-12(5-7-13)20-16(21)14-8-3-11(17)10-15(14)18/h3-8,10,19H,2,9H2,1H3,(H,20,21).
What are the key properties of 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide?
2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide has a molecular weight of 354.38 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-[4-(propylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 38352115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).