2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide

C19H13BrCl2N2O3S — CID 2331891

IUPAC2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C19H13BrCl2N2O3S/c20-12-5-8-14(9-6-12)28(26,27)24-17-4-2-1-3-15(17)19(25)23-18-10-7-13(21)11-16(18)22/h1-11,24H,(H,23,25)
InChIKeyPUZBHGPHNMRBRK-UHFFFAOYSA-N
MW500.20 g/mol
LogP5.81
Rot. Bonds5

About 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide

2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide (PubChem CID 2331891) has the molecular formula C19H13BrCl2N2O3S and a molecular weight of 500.20 g/mol. Its IUPAC name is 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide.

Molecular Properties

Compound Name2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide
PubChem CID2331891
Molecular FormulaC19H13BrCl2N2O3S
Molecular Weight500.20 g/mol
Exact Mass497.92
IUPAC Name2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1
InChIInChI=1S/C19H13BrCl2N2O3S/c20-12-5-8-14(9-6-12)28(26,27)24-17-4-2-1-3-15(17)19(25)23-18-10-7-13(21)11-16(18)22/h1-11,24H,(H,23,25)
InChIKeyPUZBHGPHNMRBRK-UHFFFAOYSA-N
XLogP5.81
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.20
LogP ≤ 55.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[4-chloro-2-(4-chlorobenzoyl)phenyl]-2-[(4-chlorophenyl)sulfonylamino]benzamide
CID 6456062
2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide
CID 2332035
2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)-N-methylbenzamide
CID 155544296
2-bromo-4-chloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 164624083
5-bromo-N-(4-chlorophenyl)-2-{[(4-chlorophenyl)sulfonyl]amino}benzamide
CID 1547772
5-bromo-2-[(4-chloro-3-nitrophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
CID 2832018
N-(2,4-dichlorophenyl)-2-[(3-nitrophenyl)sulfonylamino]benzamide
CID 139463216
2-[(4-bromophenyl)sulfonylamino]-N-(4-chlorophenyl)benzamide
CID 155536568
2-[(4-chlorophenyl)sulfonylamino]-N-[2-chloro-5-(trifluoromethyl)phenyl]benzamide
CID 2311438
N-[2-(aminocarbonyl)phenyl]-2-{[(4-chlorophenyl)sulfonyl]amino}benzamide
CID 1325152
N-(3,4-dichlorophenyl)-2-[(phenylsulfonyl)amino]benzamide
CID 2983086
2-(benzenesulfonamido)-5-chloro-N-(3,4-dichlorophenyl)benzamide
CID 23661713

Frequently Asked Questions

What is the IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide?
The IUPAC name of 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide (CID 2331891) is 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide.
What is the SMILES notation for 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide?
The canonical SMILES for 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide is O=C(Nc1ccc(Cl)cc1Cl)c1ccccc1NS(=O)(=O)c1ccc(Br)cc1.
What is the InChIKey of 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide?
The InChIKey is PUZBHGPHNMRBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrCl2N2O3S/c20-12-5-8-14(9-6-12)28(26,27)24-17-4-2-1-3-15(17)19(25)23-18-10-7-13(21)11-16(18)22/h1-11,24H,(H,23,25).
What are the key properties of 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide?
2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide has a molecular weight of 500.20 g/mol, XLogP of 5.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-bromophenyl)sulfonylamino]-N-(2,4-dichlorophenyl)benzamide is sourced from PubChem (CID 2331891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).