N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide

C21H17ClN2O4S — CID 26663686

IUPACN-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
SMILESCC(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1
InChIInChI=1S/C21H17ClN2O4S/c1-14(25)15-5-9-18(10-6-15)23-21(26)16-3-2-4-20(13-16)29(27,28)24-19-11-7-17(22)8-12-19/h2-13,24H,1H3,(H,23,26)
InChIKeyBIMXJJPNDLUXNK-UHFFFAOYSA-N
MW428.90 g/mol
LogP4.60
Rot. Bonds6

About N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide

N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide (PubChem CID 26663686) has the molecular formula C21H17ClN2O4S and a molecular weight of 428.90 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
PubChem CID26663686
Molecular FormulaC21H17ClN2O4S
Molecular Weight428.90 g/mol
Exact Mass428.06
IUPAC NameN-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
SMILESCC(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1
InChIInChI=1S/C21H17ClN2O4S/c1-14(25)15-5-9-18(10-6-15)23-21(26)16-3-2-4-20(13-16)29(27,28)24-19-11-7-17(22)8-12-19/h2-13,24H,1H3,(H,23,26)
InChIKeyBIMXJJPNDLUXNK-UHFFFAOYSA-N
XLogP4.60
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.90
LogP ≤ 54.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromophenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 1087366
4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide
CID 26592920
3-[(4-chlorophenyl)sulfamoyl]-N-(2,6-dichlorophenyl)benzamide
CID 2308611
4-[[3-[(3-acetylphenyl)sulfamoyl]benzoyl]amino]benzoic acid
CID 1355824
N-(4-methylphenyl)-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 3284384
3-[(4-chlorophenyl)sulfamoyl]-N-ethylbenzamide
CID 26637971
3-[(4-chlorophenyl)sulfamoyl]-N-(2-methylsulfonylphenyl)benzamide
CID 70115356
N-[4-[(4-chlorophenyl)sulfamoyl]phenyl]-3-fluorobenzamide
CID 94783605
N-(4-acetylphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 7542008
N-(4-acetylphenyl)-3-(butan-2-ylsulfamoyl)benzamide
CID 109062983
N-(4-chlorophenyl)-3-[[(3-fluorobenzoyl)amino]carbamoyl]benzenesulfonamide
CID 24642831
4-[[3-[(4-iodophenyl)sulfamoyl]benzoyl]amino]benzoate
CID 6968790

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide?
The IUPAC name of N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide (CID 26663686) is N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide is CC(=O)c1ccc(NC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide?
The InChIKey is BIMXJJPNDLUXNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2O4S/c1-14(25)15-5-9-18(10-6-15)23-21(26)16-3-2-4-20(13-16)29(27,28)24-19-11-7-17(22)8-12-19/h2-13,24H,1H3,(H,23,26).
What are the key properties of N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide?
N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide has a molecular weight of 428.90 g/mol, XLogP of 4.60, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide is sourced from PubChem (CID 26663686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).