2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide

C13H11Cl2NO3S — CID 4816687

IUPAC2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1Cl
InChIInChI=1S/C13H11Cl2NO3S/c1-19-12-7-6-9(14)8-11(12)16-20(17,18)13-5-3-2-4-10(13)15/h2-8,16H,1H3
InChIKeyGQOPPVJASPEMJI-UHFFFAOYSA-N
MW332.21 g/mol
LogP3.80
Rot. Bonds4

About 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide

2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide (PubChem CID 4816687) has the molecular formula C13H11Cl2NO3S and a molecular weight of 332.21 g/mol. Its IUPAC name is 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide
PubChem CID4816687
Molecular FormulaC13H11Cl2NO3S
Molecular Weight332.21 g/mol
Exact Mass330.98
IUPAC Name2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1Cl
InChIInChI=1S/C13H11Cl2NO3S/c1-19-12-7-6-9(14)8-11(12)16-20(17,18)13-5-3-2-4-10(13)15/h2-8,16H,1H3
InChIKeyGQOPPVJASPEMJI-UHFFFAOYSA-N
XLogP3.80
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.21
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-fluorobenzenesulfonamide
CID 2696930
5-chloro-N-(5-chloro-2-methoxyphenyl)-2-methoxybenzenesulfonamide
CID 1326389
2-chloro-N-(5-chloro-2-methoxyphenyl)pyridine-3-sulfonamide
CID 43388263
N-(4-amino-2-methoxyphenyl)-2-chlorobenzenesulfonamide
CID 43123342
3-chloro-N-(5-chloro-2-methoxyphenyl)-4-methoxybenzenesulfonamide
CID 5202468
2,5-dichloro-N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 1005068
N-(5-chloro-2-methoxyphenyl)sulfamoyl chloride
CID 84760623
5-chloro-N-(2-hydroxyphenyl)-2-methoxybenzenesulfonamide
CID 4664874
N-[3-[(5-chloro-2-methoxyphenyl)sulfamoyl]-4-methoxyphenyl]acetamide
CID 26952518
N-(5-chloro-2-methoxyphenyl)-2-methoxy-5-nitrobenzenesulfonamide
CID 8822417
N-(5-chloro-2-methoxyphenyl)-4-methoxy-3-methylbenzenesulfonamide
CID 7354133
N-(5-chloro-2-methoxyphenyl)-3-(2-chlorophenyl)sulfonylpropanamide
CID 8763575

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide?
The IUPAC name of 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide (CID 4816687) is 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide?
The canonical SMILES for 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide is COc1ccc(Cl)cc1NS(=O)(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide?
The InChIKey is GQOPPVJASPEMJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO3S/c1-19-12-7-6-9(14)8-11(12)16-20(17,18)13-5-3-2-4-10(13)15/h2-8,16H,1H3.
What are the key properties of 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide?
2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide has a molecular weight of 332.21 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5-chloro-2-methoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 4816687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).