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

C21H17Cl2N3O4S — CID 25471428

IUPACN-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)cc1Cl
InChIInChI=1S/C21H17Cl2N3O4S/c1-13(27)24-20-9-8-16(12-19(20)23)25-21(28)14-4-2-7-18(10-14)31(29,30)26-17-6-3-5-15(22)11-17/h2-12,26H,1H3,(H,24,27)(H,25,28)
InChIKeyICTIUSAJCLRLKU-UHFFFAOYSA-N
MW478.36 g/mol
LogP5.00
Rot. Bonds6

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

N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide (PubChem CID 25471428) has the molecular formula C21H17Cl2N3O4S and a molecular weight of 478.36 g/mol. Its IUPAC name is N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide
PubChem CID25471428
Molecular FormulaC21H17Cl2N3O4S
Molecular Weight478.36 g/mol
Exact Mass477.03
IUPAC NameN-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)cc1Cl
InChIInChI=1S/C21H17Cl2N3O4S/c1-13(27)24-20-9-8-16(12-19(20)23)25-21(28)14-4-2-7-18(10-14)31(29,30)26-17-6-3-5-15(22)11-17/h2-12,26H,1H3,(H,24,27)(H,25,28)
InChIKeyICTIUSAJCLRLKU-UHFFFAOYSA-N
XLogP5.00
TPSA104.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.36
LogP ≤ 55.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(5-acetamido-2-methylphenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide
CID 46454566
3-(benzenesulfonamido)-N-(3-chlorophenyl)benzamide
CID 7541939
3-[(3-chlorophenyl)sulfamoyl]-N-[3-(hydroxymethyl)phenyl]benzamide
CID 9300326
3-[(3-chlorophenyl)sulfamoyl]-N-(2-hydroxyphenyl)benzamide
CID 24564068
3-[(3-chlorophenyl)sulfamoyl]-N-propan-2-ylbenzamide
CID 26498991
2-[[3-[(3-chlorophenyl)sulfamoyl]benzoyl]amino]benzoic acid
CID 10296361
3-(benzenesulfonamido)-N-(3-chloro-4-methylphenyl)benzamide
CID 9412716
N-(4-acetylphenyl)-3-[(4-chlorophenyl)sulfamoyl]benzamide
CID 26663686
4-acetamido-N-[3-[(4-chlorophenyl)sulfamoyl]phenyl]benzamide
CID 26592920
N-(3-chloro-4-methoxyphenyl)-3-[(5-chloro-2-methoxyphenyl)sulfamoyl]benzamide
CID 27256046
3-chloro-N-[4-[(3,4-dichlorophenyl)sulfamoyl]-2-fluorophenyl]benzamide
CID 18892799
N-(4-acetamido-3-chlorophenyl)-3-bromobenzamide
CID 51321405

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide?
The IUPAC name of N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide (CID 25471428) is N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide is CC(=O)Nc1ccc(NC(=O)c2cccc(S(=O)(=O)Nc3cccc(Cl)c3)c2)cc1Cl.
What is the InChIKey of N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide?
The InChIKey is ICTIUSAJCLRLKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17Cl2N3O4S/c1-13(27)24-20-9-8-16(12-19(20)23)25-21(28)14-4-2-7-18(10-14)31(29,30)26-17-6-3-5-15(22)11-17/h2-12,26H,1H3,(H,24,27)(H,25,28).
What are the key properties of N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide?
N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide has a molecular weight of 478.36 g/mol, XLogP of 5.00, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-chlorophenyl)-3-[(3-chlorophenyl)sulfamoyl]benzamide is sourced from PubChem (CID 25471428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).