N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide

C13H10ClIN2O3S — CID 43246729

IUPACN-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccccc2I)c(Cl)c1
InChIInChI=1S/C13H10ClIN2O3S/c14-10-7-8(21(16,19)20)5-6-12(10)17-13(18)9-3-1-2-4-11(9)15/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyFSOHCUBLBCALIO-UHFFFAOYSA-N
MW436.66 g/mol
LogP2.84
Rot. Bonds3

About N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide

N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide (PubChem CID 43246729) has the molecular formula C13H10ClIN2O3S and a molecular weight of 436.66 g/mol. Its IUPAC name is N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide.

Molecular Properties

Compound NameN-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide
PubChem CID43246729
Molecular FormulaC13H10ClIN2O3S
Molecular Weight436.66 g/mol
Exact Mass435.91
IUPAC NameN-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2ccccc2I)c(Cl)c1
InChIInChI=1S/C13H10ClIN2O3S/c14-10-7-8(21(16,19)20)5-6-12(10)17-13(18)9-3-1-2-4-11(9)15/h1-7H,(H,17,18)(H2,16,19,20)
InChIKeyFSOHCUBLBCALIO-UHFFFAOYSA-N
XLogP2.84
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.66
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

N-(2-chloro-4-methylphenyl)-2-iodobenzamide
CID 8886012
4-chloro-N-(2-chloro-4-sulfamoylphenyl)benzamide
CID 43134088
N-(2-chlorophenyl)-2-iodobenzamide
CID 1105942
N-(2-chloro-4-sulfamoylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66475777
N-(2-chloro-4-methylphenyl)-2-methoxy-5-sulfamoylbenzamide
CID 55348812
N-(2,5-dichloro-4-methylphenyl)-2-iodobenzamide
CID 115760988
5-bromo-N-(2-chloro-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 62958134
N-(4-amino-2-chlorophenyl)-2-chlorobenzamide
CID 960633
N-(2,3-dichlorophenyl)-2-iodobenzamide
CID 1043515
2-hydroxy-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 61129726
N-(2-chloro-4-sulfamoylphenyl)-3-sulfanylpropanamide
CID 23645367
N-(5-ethylsulfonyl-2-hydroxyphenyl)-2-iodobenzamide
CID 78794976

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide?
The IUPAC name of N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide (CID 43246729) is N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide.
What is the SMILES notation for N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide?
The canonical SMILES for N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide is NS(=O)(=O)c1ccc(NC(=O)c2ccccc2I)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide?
The InChIKey is FSOHCUBLBCALIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClIN2O3S/c14-10-7-8(21(16,19)20)5-6-12(10)17-13(18)9-3-1-2-4-11(9)15/h1-7H,(H,17,18)(H2,16,19,20).
What are the key properties of N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide?
N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide has a molecular weight of 436.66 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-sulfamoylphenyl)-2-iodobenzamide is sourced from PubChem (CID 43246729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).