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

C24H19ClN4O5S2 — CID 43904807

IUPAC5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1)c1cc(NS(=O)(=O)c2ccccc2)ccc1Cl
InChIInChI=1S/C24H19ClN4O5S2/c25-23-13-10-18(28-35(31,32)20-6-2-1-3-7-20)15-22(23)24(30)27-17-8-11-21(12-9-17)36(33,34)29-19-5-4-14-26-16-19/h1-16,28-29H,(H,27,30)
InChIKeyQXYUQDGILJZDHH-UHFFFAOYSA-N
MW543.03 g/mol
LogP4.59
Rot. Bonds8

About 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide

5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (PubChem CID 43904807) has the molecular formula C24H19ClN4O5S2 and a molecular weight of 543.03 g/mol. Its IUPAC name is 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
PubChem CID43904807
Molecular FormulaC24H19ClN4O5S2
Molecular Weight543.03 g/mol
Exact Mass542.05
IUPAC Name5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1)c1cc(NS(=O)(=O)c2ccccc2)ccc1Cl
InChIInChI=1S/C24H19ClN4O5S2/c25-23-13-10-18(28-35(31,32)20-6-2-1-3-7-20)15-22(23)24(30)27-17-8-11-21(12-9-17)36(33,34)29-19-5-4-14-26-16-19/h1-16,28-29H,(H,27,30)
InChIKeyQXYUQDGILJZDHH-UHFFFAOYSA-N
XLogP4.59
TPSA134.33 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500543.03
LogP ≤ 54.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-5-[(4-methylphenyl)sulfonylamino]-N-phenylbenzamide
CID 92683065
2,4-dichloro-N-phenyl-5-(pyridin-3-ylsulfamoyl)benzamide
CID 2996026
5-(benzenesulfonamido)-N-[4-[(4-bromophenyl)sulfamoyl]phenyl]-2-chlorobenzamide
CID 46778728
5-(benzenesulfonamido)-2-chloro-N-(3-chlorophenyl)benzamide
CID 92674550
4-(benzenesulfonamido)-2-chloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 99942022
5-(benzenesulfonamido)-2-chloro-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide
CID 43909921
5-(benzenesulfonamido)-2-chloro-N-(3-methylphenyl)benzamide
CID 99954577
5-(benzenesulfonamido)-2-chloro-N-(3,5-dimethylphenyl)benzamide
CID 28575633
2-methoxy-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide
CID 92646313
2-chloro-N-(2-nitrophenyl)-5-(pyridin-3-ylsulfamoyl)benzamide
CID 25040314
1-[4-[(3,4-dichlorophenyl)sulfamoyl]phenyl]-3-phenylurea
CID 4171462
5-(benzenesulfonamido)-2-chloro-N-[4-chloro-3-(trifluoromethyl)phenyl]benzamide
CID 28634197

Frequently Asked Questions

What is the IUPAC name of 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide (CID 43904807) is 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2cccnc2)cc1)c1cc(NS(=O)(=O)c2ccccc2)ccc1Cl.
What is the InChIKey of 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
The InChIKey is QXYUQDGILJZDHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19ClN4O5S2/c25-23-13-10-18(28-35(31,32)20-6-2-1-3-7-20)15-22(23)24(30)27-17-8-11-21(12-9-17)36(33,34)29-19-5-4-14-26-16-19/h1-16,28-29H,(H,27,30).
What are the key properties of 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide?
5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide has a molecular weight of 543.03 g/mol, XLogP of 4.59, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzenesulfonamido)-2-chloro-N-[4-(pyridin-3-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 43904807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).