N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide

C19H13BrF2N2O3S — CID 2374061

IUPACN-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide
SMILESO=C(Nc1ccc(Br)cc1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1
InChIInChI=1S/C19H13BrF2N2O3S/c20-13-3-7-14(8-4-13)23-19(25)12-1-5-15(6-2-12)24-28(26,27)16-9-10-17(21)18(22)11-16/h1-11,24H,(H,23,25)
InChIKeyBLPPCMBKRHGALO-UHFFFAOYSA-N
MW467.29 g/mol
LogP4.78
Rot. Bonds5

About N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide

N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide (PubChem CID 2374061) has the molecular formula C19H13BrF2N2O3S and a molecular weight of 467.29 g/mol. Its IUPAC name is N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide
PubChem CID2374061
Molecular FormulaC19H13BrF2N2O3S
Molecular Weight467.29 g/mol
Exact Mass465.98
IUPAC NameN-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide
SMILESO=C(Nc1ccc(Br)cc1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1
InChIInChI=1S/C19H13BrF2N2O3S/c20-13-3-7-14(8-4-13)23-19(25)12-1-5-15(6-2-12)24-28(26,27)16-9-10-17(21)18(22)11-16/h1-11,24H,(H,23,25)
InChIKeyBLPPCMBKRHGALO-UHFFFAOYSA-N
XLogP4.78
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.29
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
CID 3868276
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-4-(dimethylsulfamoyl)benzamide
CID 24636547
4-[(3,4-difluorophenyl)sulfonylamino]-N-methylbenzamide
CID 25335198
N-[4-[(4-bromophenyl)sulfamoyl]phenyl]-4-methylbenzamide
CID 1333667
4-[(3,4-difluorophenyl)sulfonylamino]-N-(3,4-dimethoxyphenyl)benzamide
CID 27537974
4-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(4-fluorophenyl)benzamide
CID 42053342
N-(4-bromophenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 1087366
N-(4-bromophenyl)-4-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonylamino]benzamide
CID 37165193
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2,5-difluorobenzamide
CID 55376849
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-2-fluorobenzamide
CID 55349327
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 24636529
4-[(4-fluoro-3-methylphenyl)sulfonylamino]-N-(4-hydroxyphenyl)benzamide
CID 112771839

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide?
The IUPAC name of N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide (CID 2374061) is N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide?
The canonical SMILES for N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide is O=C(Nc1ccc(Br)cc1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1.
What is the InChIKey of N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide?
The InChIKey is BLPPCMBKRHGALO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrF2N2O3S/c20-13-3-7-14(8-4-13)23-19(25)12-1-5-15(6-2-12)24-28(26,27)16-9-10-17(21)18(22)11-16/h1-11,24H,(H,23,25).
What are the key properties of N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide?
N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide has a molecular weight of 467.29 g/mol, XLogP of 4.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide is sourced from PubChem (CID 2374061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).