5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide

C14H13Cl2NO3S — CID 3517707

IUPAC5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide
SMILESCOc1ccc(Cl)cc1S(=O)(=O)N(C)c1ccc(Cl)cc1
InChIInChI=1S/C14H13Cl2NO3S/c1-17(12-6-3-10(15)4-7-12)21(18,19)14-9-11(16)5-8-13(14)20-2/h3-9H,1-2H3
InChIKeyTZQUNWSRCOGUIB-UHFFFAOYSA-N
MW346.24 g/mol
LogP3.83
Rot. Bonds4

About 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide

5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide (PubChem CID 3517707) has the molecular formula C14H13Cl2NO3S and a molecular weight of 346.24 g/mol. Its IUPAC name is 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide
PubChem CID3517707
Molecular FormulaC14H13Cl2NO3S
Molecular Weight346.24 g/mol
Exact Mass345.00
IUPAC Name5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide
SMILESCOc1ccc(Cl)cc1S(=O)(=O)N(C)c1ccc(Cl)cc1
InChIInChI=1S/C14H13Cl2NO3S/c1-17(12-6-3-10(15)4-7-12)21(18,19)14-9-11(16)5-8-13(14)20-2/h3-9H,1-2H3
InChIKeyTZQUNWSRCOGUIB-UHFFFAOYSA-N
XLogP3.83
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.24
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[3-(hydrazinesulfonyl)-4-methoxyphenyl]-N-methylbenzenesulfonamide
CID 71945594
5-amino-N-(4-hydroxyphenyl)-2-methoxy-N-methylbenzenesulfonamide
CID 107733405
3,5-dichloro-N-(4-chlorophenyl)-2-hydroxy-N-methylbenzenesulfonamide
CID 4985281
methyl 5-chloro-2-methoxybenzenesulfonate
CID 89056294
2,5-dichloro-N-(2-methoxy-5-methylphenyl)-N-methylbenzenesulfonamide
CID 100507646
N-[4-[(2,5-dimethoxyphenyl)sulfonyl-methylamino]phenyl]-N-methylacetamide
CID 113094905
N,N-dibenzyl-5-chloro-2-methoxybenzenesulfonamide
CID 1339272
CID 70601990
CID 70601990
N-(3-chloro-4-methoxyphenyl)-3-[(4-chlorophenyl)-methylsulfamoyl]thiophene-2-carboxamide
CID 30849036
2-(5-chloro-2-methoxyphenyl)sulfonylpropan-2-amine
CID 117036237
5-chloro-N-hydroxy-2-methoxybenzenesulfonamide
CID 82083952
2,5-dichloro-N-(3,5-dichlorophenyl)-N-methylbenzenesulfonamide
CID 100507274

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide?
The IUPAC name of 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide (CID 3517707) is 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide.
What is the SMILES notation for 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide?
The canonical SMILES for 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide is COc1ccc(Cl)cc1S(=O)(=O)N(C)c1ccc(Cl)cc1.
What is the InChIKey of 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide?
The InChIKey is TZQUNWSRCOGUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO3S/c1-17(12-6-3-10(15)4-7-12)21(18,19)14-9-11(16)5-8-13(14)20-2/h3-9H,1-2H3.
What are the key properties of 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide?
5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide has a molecular weight of 346.24 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(4-chlorophenyl)-2-methoxy-N-methylbenzenesulfonamide is sourced from PubChem (CID 3517707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).