4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide

C17H19ClN2O4S — CID 24539437

IUPAC4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(C(=O)NC(C)C)ccc2Cl)cc1
InChIInChI=1S/C17H19ClN2O4S/c1-11(2)19-17(21)12-4-9-15(18)16(10-12)25(22,23)20-13-5-7-14(24-3)8-6-13/h4-11,20H,1-3H3,(H,19,21)
InChIKeyVREZLHSRDYWZII-UHFFFAOYSA-N
MW382.87 g/mol
LogP3.29
Rot. Bonds6

About 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide

4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide (PubChem CID 24539437) has the molecular formula C17H19ClN2O4S and a molecular weight of 382.87 g/mol. Its IUPAC name is 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide
PubChem CID24539437
Molecular FormulaC17H19ClN2O4S
Molecular Weight382.87 g/mol
Exact Mass382.08
IUPAC Name4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide
SMILESCOc1ccc(NS(=O)(=O)c2cc(C(=O)NC(C)C)ccc2Cl)cc1
InChIInChI=1S/C17H19ClN2O4S/c1-11(2)19-17(21)12-4-9-15(18)16(10-12)25(22,23)20-13-5-7-14(24-3)8-6-13/h4-11,20H,1-3H3,(H,19,21)
InChIKeyVREZLHSRDYWZII-UHFFFAOYSA-N
XLogP3.29
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.87
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-(phenylsulfamoyl)benzamide
CID 99951817
4-chloro-N-(3,5-dimethoxyphenyl)-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 24537222
4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-phenylbenzamide
CID 1102140
4-chloro-3-[(4-fluorophenyl)sulfamoyl]-N-(4-methoxyphenyl)benzamide
CID 27228973
4-chloro-3-[(3,4-dimethylphenyl)sulfamoyl]-N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
CID 94020007
N-butan-2-yl-4-chloro-3-[(4-ethoxyphenyl)sulfamoyl]benzamide
CID 42909894
4-chloro-N-[(2-methoxyphenyl)methyl]-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 24536359
4-chloro-N-[2-(dimethylamino)-2-phenylethyl]-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 24536278
[(2R)-1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoate
CID 40943134
4-chloro-N-[1-(3,4-dimethoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 132617871
4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-[[3-(methylcarbamoyl)phenyl]methyl]benzamide
CID 30858884
4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-(2-phenylsulfanylethyl)benzamide
CID 24549447

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide?
The IUPAC name of 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide (CID 24539437) is 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide.
What is the SMILES notation for 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide?
The canonical SMILES for 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide is COc1ccc(NS(=O)(=O)c2cc(C(=O)NC(C)C)ccc2Cl)cc1.
What is the InChIKey of 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide?
The InChIKey is VREZLHSRDYWZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O4S/c1-11(2)19-17(21)12-4-9-15(18)16(10-12)25(22,23)20-13-5-7-14(24-3)8-6-13/h4-11,20H,1-3H3,(H,19,21).
What are the key properties of 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide?
4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide has a molecular weight of 382.87 g/mol, XLogP of 3.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]-N-propan-2-ylbenzamide is sourced from PubChem (CID 24539437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).