N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide

C21H21NO4S — CID 46022004

IUPACN-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
SMILESCOc1ccc(N(Cc2ccccc2OC)S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H21NO4S/c1-25-19-14-12-18(13-15-19)22(16-17-8-6-7-11-21(17)26-2)27(23,24)20-9-4-3-5-10-20/h3-15H,16H2,1-2H3
InChIKeyVQIBQCHTPFEZLX-UHFFFAOYSA-N
MW383.47 g/mol
LogP4.10
Rot. Bonds7

About N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide

N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide (PubChem CID 46022004) has the molecular formula C21H21NO4S and a molecular weight of 383.47 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
PubChem CID46022004
Molecular FormulaC21H21NO4S
Molecular Weight383.47 g/mol
Exact Mass383.12
IUPAC NameN-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
SMILESCOc1ccc(N(Cc2ccccc2OC)S(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H21NO4S/c1-25-19-14-12-18(13-15-19)22(16-17-8-6-7-11-21(17)26-2)27(23,24)20-9-4-3-5-10-20/h3-15H,16H2,1-2H3
InChIKeyVQIBQCHTPFEZLX-UHFFFAOYSA-N
XLogP4.10
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-(4-methoxyphenyl)-N-[(2-methylphenyl)methyl]benzenesulfonamide
CID 46021847
N-(3,4-dimethoxyphenyl)-N-[(4-methoxyphenyl)methyl]benzenesulfonamide
CID 24719654
N-(4-chlorophenyl)-N-[(2-fluorophenyl)methyl]-4-methoxybenzenesulfonamide
CID 42841700
4-chloro-N-[(2-fluorophenyl)methyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 46152500
N-[(6-fluoroquinolin-8-yl)methyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 38828810
N-butyl-N-(4-methoxyphenyl)benzenesulfonamide
CID 35766210
N-(4-methoxyphenyl)-N-(2-phenoxyethyl)benzenesulfonamide
CID 4793747
4-amino-N-benzyl-N-(4-methoxyphenyl)benzenesulfonamide
CID 100591331
2-[N-(benzenesulfonyl)-4-ethylanilino]-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 92647368
2-[N-(benzenesulfonyl)-2,5-dimethoxyanilino]-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 92673487
N-(3,4-dimethoxyphenyl)-4-fluoro-N-[(2-fluorophenyl)methyl]benzenesulfonamide
CID 46022040
4-chloro-N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-(4-methoxyphenyl)benzenesulfonamide
CID 2533151

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
The IUPAC name of N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide (CID 46022004) is N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide.
What is the SMILES notation for N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
The canonical SMILES for N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide is COc1ccc(N(Cc2ccccc2OC)S(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
The InChIKey is VQIBQCHTPFEZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO4S/c1-25-19-14-12-18(13-15-19)22(16-17-8-6-7-11-21(17)26-2)27(23,24)20-9-4-3-5-10-20/h3-15H,16H2,1-2H3.
What are the key properties of N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide?
N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide has a molecular weight of 383.47 g/mol, XLogP of 4.10, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]benzenesulfonamide is sourced from PubChem (CID 46022004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).