N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide

C21H19NO4S — CID 58597404

IUPACN-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2ccccc2C(C)=O)cc1
InChIInChI=1S/C21H19NO4S/c1-15(23)18-7-3-4-8-19(18)20-9-5-6-10-21(20)22-27(24,25)17-13-11-16(26-2)12-14-17/h3-14,22H,1-2H3
InChIKeyWZDMTGCEFSJDHV-UHFFFAOYSA-N
MW381.45 g/mol
LogP4.37
Rot. Bonds6

About N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide

N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide (PubChem CID 58597404) has the molecular formula C21H19NO4S and a molecular weight of 381.45 g/mol. Its IUPAC name is N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide
PubChem CID58597404
Molecular FormulaC21H19NO4S
Molecular Weight381.45 g/mol
Exact Mass381.10
IUPAC NameN-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2ccccc2C(C)=O)cc1
InChIInChI=1S/C21H19NO4S/c1-15(23)18-7-3-4-8-19(18)20-9-5-6-10-21(20)22-27(24,25)17-13-11-16(26-2)12-14-17/h3-14,22H,1-2H3
InChIKeyWZDMTGCEFSJDHV-UHFFFAOYSA-N
XLogP4.37
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.45
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[2-(1-hydroxyethyl)phenyl]phenyl]-4-methoxybenzenesulfonamide
CID 69255044
2-(benzenesulfonamido)-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 126414109
N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]-2-methylpyridine-3-carboxamide
CID 15293871
N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]benzamide
CID 15294862
N-(2-fluorophenyl)-4-methoxybenzenesulfonamide
CID 711138
4-hydroxy-N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]benzamide
CID 15294835
2-benzyl-3-[(4-methoxyphenyl)sulfonylamino]benzoic acid
CID 70053519
2-[(4-methoxyphenyl)sulfonylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 7541926
N-(3-chloro-2-hydroxyphenyl)-4-methoxybenzenesulfonamide
CID 78995720
methyl 2-[(4-propan-2-yloxyphenyl)sulfonylamino]benzoate
CID 110756559
N-[(2-methoxyphenyl)methyl]-2-[(4-methoxyphenyl)sulfonylamino]-N-methylbenzamide
CID 25497844
N-[2-[(4-methoxyphenyl)sulfonylamino]phenyl]formamide
CID 15294855

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide?
The IUPAC name of N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide (CID 58597404) is N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide.
What is the SMILES notation for N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide?
The canonical SMILES for N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccccc2-c2ccccc2C(C)=O)cc1.
What is the InChIKey of N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide?
The InChIKey is WZDMTGCEFSJDHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO4S/c1-15(23)18-7-3-4-8-19(18)20-9-5-6-10-21(20)22-27(24,25)17-13-11-16(26-2)12-14-17/h3-14,22H,1-2H3.
What are the key properties of N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide?
N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide has a molecular weight of 381.45 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-acetylphenyl)phenyl]-4-methoxybenzenesulfonamide is sourced from PubChem (CID 58597404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).