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

C14H14ClNO4S — CID 839358

IUPAC5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(Cl)ccc1OC
InChIInChI=1S/C14H14ClNO4S/c1-19-12-6-4-3-5-11(12)16-21(17,18)14-9-10(15)7-8-13(14)20-2/h3-9,16H,1-2H3
InChIKeyAPQAZYHTLRCCQQ-UHFFFAOYSA-N
MW327.79 g/mol
LogP3.16
Rot. Bonds5

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

5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide (PubChem CID 839358) has the molecular formula C14H14ClNO4S and a molecular weight of 327.79 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide.

Molecular Properties

Compound Name5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide
PubChem CID839358
Molecular FormulaC14H14ClNO4S
Molecular Weight327.79 g/mol
Exact Mass327.03
IUPAC Name5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide
SMILESCOc1ccccc1NS(=O)(=O)c1cc(Cl)ccc1OC
InChIInChI=1S/C14H14ClNO4S/c1-19-12-6-4-3-5-11(12)16-21(17,18)14-9-10(15)7-8-13(14)20-2/h3-9,16H,1-2H3
InChIKeyAPQAZYHTLRCCQQ-UHFFFAOYSA-N
XLogP3.16
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.79
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-methoxyphenyl)benzene-1-sulfonamide
CID 579335
4-Chloro-2'-methoxybenzenesulfonanilide
CID 310128
5-amino-N-(2-chlorophenyl)-2-methoxybenzene-1-sulfonamide
CID 3388857
N-(5-chloro-2-methoxyphenyl)-4-methoxybenzenesulfonamide
CID 770818
4-chloro-N-(2-ethoxyphenyl)benzene-1-sulfonamide
CID 710432
5-chloro-N-(4-ethoxyphenyl)-2-methoxybenzenesulfonamide
CID 802882
3-chloro-N-(4-methoxyphenyl)benzenesulfonamide
CID 889795
N-(5-chloro-2-methoxyphenyl)-3,4-dimethoxybenzenesulfonamide
CID 1141973
N-(3,5-dichlorophenyl)-2,5-dimethoxybenzenesulfonamide
CID 1294812
3-chloro-N-(3,4-difluorophenyl)-4-methoxybenzenesulfonamide
CID 2227762
N-(5-chloro-2-hydroxyphenyl)-4-ethoxybenzenesulfonamide
CID 2980565
N-{4-[(5-chloro-2-methoxyphenyl)sulfamoyl]phenyl}acetamide
CID 989525

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide?
The IUPAC name of 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide (CID 839358) is 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide.
What is the SMILES notation for 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide?
The canonical SMILES for 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide is COc1ccccc1NS(=O)(=O)c1cc(Cl)ccc1OC.
What is the InChIKey of 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide?
The InChIKey is APQAZYHTLRCCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO4S/c1-19-12-6-4-3-5-11(12)16-21(17,18)14-9-10(15)7-8-13(14)20-2/h3-9,16H,1-2H3.
What are the key properties of 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide?
5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide has a molecular weight of 327.79 g/mol, XLogP of 3.16, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-N-(2-methoxyphenyl)benzenesulfonamide is sourced from PubChem (CID 839358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).