4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide

C19H14BrClN2O3S — CID 3868276

IUPAC4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1
InChIInChI=1S/C19H14BrClN2O3S/c20-14-3-11-18(12-4-14)27(25,26)23-17-7-1-13(2-8-17)19(24)22-16-9-5-15(21)6-10-16/h1-12,23H,(H,22,24)
InChIKeyQRIXWVVGRZUBQG-UHFFFAOYSA-N
MW465.76 g/mol
LogP5.16
Rot. Bonds5

About 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide

4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide (PubChem CID 3868276) has the molecular formula C19H14BrClN2O3S and a molecular weight of 465.76 g/mol. Its IUPAC name is 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide.

Molecular Properties

Compound Name4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
PubChem CID3868276
Molecular FormulaC19H14BrClN2O3S
Molecular Weight465.76 g/mol
Exact Mass463.96
IUPAC Name4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1
InChIInChI=1S/C19H14BrClN2O3S/c20-14-3-11-18(12-4-14)27(25,26)23-17-7-1-13(2-8-17)19(24)22-16-9-5-15(21)6-10-16/h1-12,23H,(H,22,24)
InChIKeyQRIXWVVGRZUBQG-UHFFFAOYSA-N
XLogP5.16
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.76
LogP ≤ 55.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 7720348
4-[(4-chlorophenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
CID 7553542
4-[(4-chlorophenyl)sulfamoyl]-N-(4-methylphenyl)benzamide
CID 9411666
N-[4-[(4-bromophenyl)sulfamoyl]phenyl]-4-methylbenzamide
CID 1333667
N-(4-bromophenyl)-4-[(3,4-difluorophenyl)sulfonylamino]benzamide
CID 2374061
N-(4-bromophenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 1087366
4-chloro-N-[4-[[4-(trifluoromethyl)phenyl]sulfamoyl]phenyl]benzamide
CID 2730887
N-[4-[[4-[(4-chlorophenyl)sulfamoyl]benzoyl]amino]phenyl]furan-2-carboxamide
CID 42014553
N-(4-bromophenyl)-4-(methylsulfamoyl)benzamide
CID 35436567
4-chloro-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 4924513
4-chloro-N-[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]benzamide
CID 2725735
N-(4-methylphenyl)-4-[(4-methylphenyl)sulfamoyl]benzamide
CID 2687815

Frequently Asked Questions

What is the IUPAC name of 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide?
The IUPAC name of 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide (CID 3868276) is 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide.
What is the SMILES notation for 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide?
The canonical SMILES for 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide is O=C(Nc1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1.
What is the InChIKey of 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide?
The InChIKey is QRIXWVVGRZUBQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14BrClN2O3S/c20-14-3-11-18(12-4-14)27(25,26)23-17-7-1-13(2-8-17)19(24)22-16-9-5-15(21)6-10-16/h1-12,23H,(H,22,24).
What are the key properties of 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide?
4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide has a molecular weight of 465.76 g/mol, XLogP of 5.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide is sourced from PubChem (CID 3868276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).