2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide

C19H16ClN3O5S2 — CID 44898447

IUPAC2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H16ClN3O5S2/c20-13-5-9-16(10-6-13)30(27,28)23-18-4-2-1-3-17(18)19(24)22-14-7-11-15(12-8-14)29(21,25)26/h1-12,23H,(H,22,24)(H2,21,25,26)
InChIKeyINUNPUFFPFKXLF-UHFFFAOYSA-N
MW465.94 g/mol
LogP3.04
Rot. Bonds6

About 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide

2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide (PubChem CID 44898447) has the molecular formula C19H16ClN3O5S2 and a molecular weight of 465.94 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide
PubChem CID44898447
Molecular FormulaC19H16ClN3O5S2
Molecular Weight465.94 g/mol
Exact Mass465.02
IUPAC Name2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)cc1
InChIInChI=1S/C19H16ClN3O5S2/c20-13-5-9-16(10-6-13)30(27,28)23-18-4-2-1-3-17(18)19(24)22-14-7-11-15(12-8-14)29(21,25)26/h1-12,23H,(H,22,24)(H2,21,25,26)
InChIKeyINUNPUFFPFKXLF-UHFFFAOYSA-N
XLogP3.04
TPSA135.43 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500465.94
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(benzenesulfonamido)-N-(4-chlorophenyl)benzamide
CID 1243115
N-(3-chlorophenyl)-2-[(4-chlorophenyl)sulfonylamino]benzamide
CID 44898444
N-[4-(benzylsulfamoyl)phenyl]-2-[(4-chlorophenyl)sulfonylamino]benzamide
CID 66863129
2-[[2-[(4-chlorophenyl)sulfonylamino]benzoyl]amino]benzamide
CID 1325152
2-chloro-5-[[2-[(4-chlorophenyl)carbamoyl]phenyl]sulfamoyl]benzoic acid
CID 10205135
2-hydrazinyl-N-(4-sulfamoylphenyl)benzamide
CID 62234840
2-[(4-chlorophenyl)sulfonylamino]-N-(1,3-dioxoisoindol-5-yl)benzamide
CID 44898443
2-[(4-chlorophenyl)sulfonylamino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 35893819
2-[(4-bromophenyl)sulfonylamino]-N-phenylbenzamide
CID 2332035
2-(benzenesulfonamido)-N-(3,4-difluorophenyl)benzamide
CID 126415100
2-[(4-chlorophenyl)sulfonylamino]-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 55519672
N-(4-carbamoylphenyl)-5-chloro-2-[(4-chlorophenyl)sulfonylamino]benzamide
CID 22646280

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide (CID 44898447) is 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide is NS(=O)(=O)c1ccc(NC(=O)c2ccccc2NS(=O)(=O)c2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide?
The InChIKey is INUNPUFFPFKXLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O5S2/c20-13-5-9-16(10-6-13)30(27,28)23-18-4-2-1-3-17(18)19(24)22-14-7-11-15(12-8-14)29(21,25)26/h1-12,23H,(H,22,24)(H2,21,25,26).
What are the key properties of 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide?
2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide has a molecular weight of 465.94 g/mol, XLogP of 3.04, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)benzamide is sourced from PubChem (CID 44898447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).