N-(3,5-difluorophenyl)-4-sulfamoylbenzamide

C13H10F2N2O3S — CID 27055023

IUPACN-(3,5-difluorophenyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1
InChIInChI=1S/C13H10F2N2O3S/c14-9-5-10(15)7-11(6-9)17-13(18)8-1-3-12(4-2-8)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyBAMPUPKKUBFGJS-UHFFFAOYSA-N
MW312.30 g/mol
LogP1.86
Rot. Bonds3

About N-(3,5-difluorophenyl)-4-sulfamoylbenzamide

N-(3,5-difluorophenyl)-4-sulfamoylbenzamide (PubChem CID 27055023) has the molecular formula C13H10F2N2O3S and a molecular weight of 312.30 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-4-sulfamoylbenzamide
PubChem CID27055023
Molecular FormulaC13H10F2N2O3S
Molecular Weight312.30 g/mol
Exact Mass312.04
IUPAC NameN-(3,5-difluorophenyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1
InChIInChI=1S/C13H10F2N2O3S/c14-9-5-10(15)7-11(6-9)17-13(18)8-1-3-12(4-2-8)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyBAMPUPKKUBFGJS-UHFFFAOYSA-N
XLogP1.86
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.30
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-N-(4-sulfamoylphenyl)benzamide
CID 766030
N-(3-fluoro-5-sulfamoylphenyl)-6-methylpyridine-3-carboxamide
CID 51975647
N-(2,2-difluoro-1,3-benzodioxol-5-yl)-4-sulfamoylbenzamide
CID 26954340
N-(3,5-difluorophenyl)-4-(methylsulfonylmethyl)benzamide
CID 27054975
N-naphthalen-2-yl-4-sulfamoylbenzamide
CID 24638963
1-oxido-N-(4-sulfamoylphenyl)pyridin-1-ium-4-carboxamide
CID 16961374
2-chloro-N-(3-fluoro-5-sulfamoylphenyl)benzamide
CID 61132724
3,5-diamino-N-(3,5-difluorophenyl)benzamide
CID 61091904
6-amino-N-(3,5-difluorophenyl)pyridine-3-carboxamide
CID 62154384
3,5-ditert-butyl-N-(4-sulfamoylphenyl)benzamide
CID 2322744
3-bromo-4-chloro-N-(3,5-difluorophenyl)benzamide
CID 114025876
3-(4-fluorophenyl)-N-(4-sulfamoylphenyl)-1H-pyrazole-5-carboxamide
CID 45030518

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-4-sulfamoylbenzamide?
The IUPAC name of N-(3,5-difluorophenyl)-4-sulfamoylbenzamide (CID 27055023) is N-(3,5-difluorophenyl)-4-sulfamoylbenzamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-4-sulfamoylbenzamide?
The canonical SMILES for N-(3,5-difluorophenyl)-4-sulfamoylbenzamide is NS(=O)(=O)c1ccc(C(=O)Nc2cc(F)cc(F)c2)cc1.
What is the InChIKey of N-(3,5-difluorophenyl)-4-sulfamoylbenzamide?
The InChIKey is BAMPUPKKUBFGJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2O3S/c14-9-5-10(15)7-11(6-9)17-13(18)8-1-3-12(4-2-8)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20).
What are the key properties of N-(3,5-difluorophenyl)-4-sulfamoylbenzamide?
N-(3,5-difluorophenyl)-4-sulfamoylbenzamide has a molecular weight of 312.30 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-4-sulfamoylbenzamide is sourced from PubChem (CID 27055023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).