N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide

C15H16ClNO4S — CID 155537500

IUPACN-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2OC)cc1
InChIInChI=1S/C15H16ClNO4S/c1-3-21-12-5-7-13(8-6-12)22(18,19)17-14-9-4-11(16)10-15(14)20-2/h4-10,17H,3H2,1-2H3
InChIKeyQEUONJYCIZVJHO-UHFFFAOYSA-N
MW341.82 g/mol
LogP3.55
Rot. Bonds6

About N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide

N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide (PubChem CID 155537500) has the molecular formula C15H16ClNO4S and a molecular weight of 341.82 g/mol. Its IUPAC name is N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide
PubChem CID155537500
Molecular FormulaC15H16ClNO4S
Molecular Weight341.82 g/mol
Exact Mass341.05
IUPAC NameN-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2OC)cc1
InChIInChI=1S/C15H16ClNO4S/c1-3-21-12-5-7-13(8-6-12)22(18,19)17-14-9-4-11(16)10-15(14)20-2/h4-10,17H,3H2,1-2H3
InChIKeyQEUONJYCIZVJHO-UHFFFAOYSA-N
XLogP3.55
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.82
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-ethoxyphenyl)sulfonylamino]-N-(2-methoxyphenyl)benzenesulfonamide
CID 22202817
N-(5-chloro-2-methoxyphenyl)-3,4-diethoxybenzenesulfonamide
CID 9172723
N-(2-chloro-4-methylphenyl)-4-ethoxybenzenesulfonamide
CID 7514268
4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
CID 7559506
N-(4-chloro-2-methylphenyl)-4-methoxybenzenesulfonamide
CID 4995778
N-(5-chloro-2-methoxyphenyl)-4-ethoxy-3-propan-2-ylbenzenesulfonamide
CID 6456783
4-ethoxy-N-(2-fluoro-4-methylphenyl)benzenesulfonamide
CID 8523206
N-(4-chloro-2-iodophenyl)-4-methoxybenzenesulfonamide
CID 103764001
4-chloro-N-(2-chloro-4-methoxyphenyl)benzenesulfonamide
CID 4994976
N-(5-chloro-2-ethoxyphenyl)benzenesulfonamide
CID 47310702
4-ethoxy-N-(4-methoxyphenyl)benzenesulfonamide
CID 4202178
N-(cyclopropylmethyl)-2-[(4-ethoxyphenyl)sulfonylamino]-4,5-dimethoxybenzamide
CID 24667240

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide?
The IUPAC name of N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide (CID 155537500) is N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide.
What is the SMILES notation for N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide?
The canonical SMILES for N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2OC)cc1.
What is the InChIKey of N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide?
The InChIKey is QEUONJYCIZVJHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO4S/c1-3-21-12-5-7-13(8-6-12)22(18,19)17-14-9-4-11(16)10-15(14)20-2/h4-10,17H,3H2,1-2H3.
What are the key properties of N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide?
N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide has a molecular weight of 341.82 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxyphenyl)-4-ethoxybenzenesulfonamide is sourced from PubChem (CID 155537500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).