4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide

C13H10F2N2O3S — CID 38765202

IUPAC4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cc(C(=O)Nc2ccccc2F)ccc1F
InChIInChI=1S/C13H10F2N2O3S/c14-9-3-1-2-4-11(9)17-13(18)8-5-6-10(15)12(7-8)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyRVEOGPLPLIHUPP-UHFFFAOYSA-N
MW312.30 g/mol
LogP1.86
Rot. Bonds3

About 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide

4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide (PubChem CID 38765202) has the molecular formula C13H10F2N2O3S and a molecular weight of 312.30 g/mol. Its IUPAC name is 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide.

Molecular Properties

Compound Name4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide
PubChem CID38765202
Molecular FormulaC13H10F2N2O3S
Molecular Weight312.30 g/mol
Exact Mass312.04
IUPAC Name4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide
SMILESNS(=O)(=O)c1cc(C(=O)Nc2ccccc2F)ccc1F
InChIInChI=1S/C13H10F2N2O3S/c14-9-3-1-2-4-11(9)17-13(18)8-5-6-10(15)12(7-8)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyRVEOGPLPLIHUPP-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

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide?
The IUPAC name of 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide (CID 38765202) is 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide.
What is the SMILES notation for 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide?
The canonical SMILES for 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide is NS(=O)(=O)c1cc(C(=O)Nc2ccccc2F)ccc1F.
What is the InChIKey of 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide?
The InChIKey is RVEOGPLPLIHUPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2N2O3S/c14-9-3-1-2-4-11(9)17-13(18)8-5-6-10(15)12(7-8)21(16,19)20/h1-7H,(H,17,18)(H2,16,19,20).
What are the key properties of 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide?
4-fluoro-N-(2-fluorophenyl)-3-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 4-fluoro-N-(2-fluorophenyl)-3-sulfamoylbenzamide is sourced from PubChem (CID 38765202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).