4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide

C13H10Cl3NO2S — CID 123943887

IUPAC4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide
SMILESCc1cc(Cl)ccc1S(=O)(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H10Cl3NO2S/c1-8-4-9(14)2-3-13(8)20(18,19)17-12-6-10(15)5-11(16)7-12/h2-7,17H,1H3
InChIKeyVDLOWLXVXGTCPJ-UHFFFAOYSA-N
MW350.65 g/mol
LogP4.76
Rot. Bonds3

About 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide

4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide (PubChem CID 123943887) has the molecular formula C13H10Cl3NO2S and a molecular weight of 350.65 g/mol. Its IUPAC name is 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide
PubChem CID123943887
Molecular FormulaC13H10Cl3NO2S
Molecular Weight350.65 g/mol
Exact Mass348.95
IUPAC Name4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide
SMILESCc1cc(Cl)ccc1S(=O)(=O)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C13H10Cl3NO2S/c1-8-4-9(14)2-3-13(8)20(18,19)17-12-6-10(15)5-11(16)7-12/h2-7,17H,1H3
InChIKeyVDLOWLXVXGTCPJ-UHFFFAOYSA-N
XLogP4.76
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.65
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-(3,5-dichlorophenyl)-2,5-dimethylbenzenesulfonamide
CID 22773548
4-[(4-chloro-2-methylphenyl)sulfonylamino]benzamide
CID 60532889
2,5-dibromo-N-(3,5-dichlorophenyl)-4-methylbenzenesulfonamide
CID 81427019
4-chloro-N-(2,5-dimethylphenyl)-2-methylbenzenesulfonamide
CID 47308842
4-chloro-N-(4-chloro-3-nitrophenyl)-2-methylbenzenesulfonamide
CID 60533121
4-chloro-N-[3-(methoxymethyl)phenyl]-2-methylbenzenesulfonamide
CID 87026734
N-(3,5-dichlorophenyl)-2-methylsulfonylbenzenesulfonamide
CID 55532986
4-chloro-N-(2,3-dihydro-1H-indol-5-yl)-2-methylbenzenesulfonamide
CID 43604283
4-chloro-N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-methylbenzenesulfonamide
CID 60532674
N-(5-amino-2-fluorophenyl)-4-chloro-2-methylbenzenesulfonamide
CID 43604953
4-chloro-2-methyl-N-(1,3,4-thiadiazol-2-yl)benzenesulfonamide
CID 75389571
N-(2-aminobutyl)-4-chloro-2-methylbenzenesulfonamide
CID 63730781

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide?
The IUPAC name of 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide (CID 123943887) is 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide.
What is the SMILES notation for 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide?
The canonical SMILES for 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide is Cc1cc(Cl)ccc1S(=O)(=O)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide?
The InChIKey is VDLOWLXVXGTCPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl3NO2S/c1-8-4-9(14)2-3-13(8)20(18,19)17-12-6-10(15)5-11(16)7-12/h2-7,17H,1H3.
What are the key properties of 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide?
4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide has a molecular weight of 350.65 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3,5-dichlorophenyl)-2-methylbenzenesulfonamide is sourced from PubChem (CID 123943887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).