N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide

C14H12F2N2O3S — CID 153066549

IUPACN-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide
SMILESCc1c(F)ccc(NC(=O)c2cccc(S(N)(=O)=O)c2)c1F
InChIInChI=1S/C14H12F2N2O3S/c1-8-11(15)5-6-12(13(8)16)18-14(19)9-3-2-4-10(7-9)22(17,20)21/h2-7H,1H3,(H,18,19)(H2,17,20,21)
InChIKeyVKMOXAIJZZNGLG-UHFFFAOYSA-N
MW326.32 g/mol
LogP2.17
Rot. Bonds3

About N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide

N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide (PubChem CID 153066549) has the molecular formula C14H12F2N2O3S and a molecular weight of 326.32 g/mol. Its IUPAC name is N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide
PubChem CID153066549
Molecular FormulaC14H12F2N2O3S
Molecular Weight326.32 g/mol
Exact Mass326.05
IUPAC NameN-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide
SMILESCc1c(F)ccc(NC(=O)c2cccc(S(N)(=O)=O)c2)c1F
InChIInChI=1S/C14H12F2N2O3S/c1-8-11(15)5-6-12(13(8)16)18-14(19)9-3-2-4-10(7-9)22(17,20)21/h2-7H,1H3,(H,18,19)(H2,17,20,21)
InChIKeyVKMOXAIJZZNGLG-UHFFFAOYSA-N
XLogP2.17
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.32
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-5-sulfamoylphenyl)-3-hydroxybenzamide
CID 61129797
3-fluoro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 4155198
N-(5-chloro-2-fluorophenyl)-3-methylsulfonylbenzamide
CID 51149042
3-[methoxy(methyl)sulfamoyl]-N-(2,3,4-trifluorophenyl)benzamide
CID 18197948
3-methylsulfonyl-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]benzamide
CID 27812742
3-chloro-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 5211673
N-(3-hydroxy-2-methylphenyl)-3-methylsulfonylbenzamide
CID 64792707
3-methylsulfonyl-N-(4-sulfamoylphenyl)benzamide
CID 7565696
3-amino-4-fluoro-N-(3-sulfamoylphenyl)benzamide
CID 43436961
3-amino-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 43710895
N-(3-bromo-4-fluorophenyl)-3-methylsulfonylbenzamide
CID 115661329
3-(prop-2-enylsulfamoyl)-N-(2,3,4-trifluorophenyl)benzamide
CID 109062412

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide?
The IUPAC name of N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide (CID 153066549) is N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide.
What is the SMILES notation for N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide?
The canonical SMILES for N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide is Cc1c(F)ccc(NC(=O)c2cccc(S(N)(=O)=O)c2)c1F.
What is the InChIKey of N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide?
The InChIKey is VKMOXAIJZZNGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O3S/c1-8-11(15)5-6-12(13(8)16)18-14(19)9-3-2-4-10(7-9)22(17,20)21/h2-7H,1H3,(H,18,19)(H2,17,20,21).
What are the key properties of N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide?
N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide has a molecular weight of 326.32 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluoro-3-methylphenyl)-3-sulfamoylbenzamide is sourced from PubChem (CID 153066549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).