3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide

C24H20N4O5S2 — CID 92677705

IUPAC3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C24H20N4O5S2/c29-24(18-7-6-8-20(17-18)27-34(30,31)21-9-2-1-3-10-21)26-19-12-14-22(15-13-19)35(32,33)28-23-11-4-5-16-25-23/h1-17,27H,(H,25,28)(H,26,29)
InChIKeyMQKGBXORLGJAGZ-UHFFFAOYSA-N
MW508.58 g/mol
LogP3.94
Rot. Bonds8

About 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide

3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 92677705) has the molecular formula C24H20N4O5S2 and a molecular weight of 508.58 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
PubChem CID92677705
Molecular FormulaC24H20N4O5S2
Molecular Weight508.58 g/mol
Exact Mass508.09
IUPAC Name3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C24H20N4O5S2/c29-24(18-7-6-8-20(17-18)27-34(30,31)21-9-2-1-3-10-21)26-19-12-14-22(15-13-19)35(32,33)28-23-11-4-5-16-25-23/h1-17,27H,(H,25,28)(H,26,29)
InChIKeyMQKGBXORLGJAGZ-UHFFFAOYSA-N
XLogP3.94
TPSA134.33 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500508.58
LogP ≤ 53.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-3-[[3-(pyridin-2-ylsulfamoyl)benzoyl]amino]benzamide
CID 142738684
3,4-dichloro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078174
3,4-dimethyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078179
3-[[3-(phenylcarbamoyl)phenyl]sulfonylamino]benzoate
CID 4100122
4-[[4-(pyridin-2-ylsulfamoyl)phenyl]sulfamoyl]benzoic acid
CID 4918646
4-(methanesulfonamido)-3-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 30396142
3-(benzenesulfonamido)-N-naphthalen-2-ylbenzamide
CID 41448840
3-[(4-methyl-2-pyridinyl)sulfamoyl]-N-phenylbenzamide
CID 27187007
4-methyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide;2,2,2-trifluoroacetic acid
CID 53257044
3-[(4-tert-butylphenyl)sulfonylamino]-N-pyridin-4-ylbenzamide
CID 47092083
N-[4-(pyridin-2-ylsulfamoyl)phenyl]naphthalene-1-carboxamide
CID 19204277
3-(benzenesulfonamido)-N-(3-chlorophenyl)benzamide
CID 7541939

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide (CID 92677705) is 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)cc1)c1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is MQKGBXORLGJAGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O5S2/c29-24(18-7-6-8-20(17-18)27-34(30,31)21-9-2-1-3-10-21)26-19-12-14-22(15-13-19)35(32,33)28-23-11-4-5-16-25-23/h1-17,27H,(H,25,28)(H,26,29).
What are the key properties of 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide?
3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide has a molecular weight of 508.58 g/mol, XLogP of 3.94, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 92677705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).