4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide

C23H28ClN3O4S — CID 43071932

IUPAC4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)c1
InChIInChI=1S/C23H28ClN3O4S/c1-26(2)23(29)17-11-14-20(24)21(15-17)25-22(28)16-9-12-19(13-10-16)32(30,31)27(3)18-7-5-4-6-8-18/h9-15,18H,4-8H2,1-3H3,(H,25,28)
InChIKeyQIBYJMYLSPESRE-UHFFFAOYSA-N
MW478.01 g/mol
LogP4.25
Rot. Bonds6

About 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide

4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide (PubChem CID 43071932) has the molecular formula C23H28ClN3O4S and a molecular weight of 478.01 g/mol. Its IUPAC name is 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide
PubChem CID43071932
Molecular FormulaC23H28ClN3O4S
Molecular Weight478.01 g/mol
Exact Mass477.15
IUPAC Name4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)c1
InChIInChI=1S/C23H28ClN3O4S/c1-26(2)23(29)17-11-14-20(24)21(15-17)25-22(28)16-9-12-19(13-10-16)32(30,31)27(3)18-7-5-4-6-8-18/h9-15,18H,4-8H2,1-3H3,(H,25,28)
InChIKeyQIBYJMYLSPESRE-UHFFFAOYSA-N
XLogP4.25
TPSA86.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500478.01
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide 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-(2-chlorophenyl)-4-[cyclopropyl(methyl)sulfamoyl]benzamide
CID 41364040
N-(4-chloro-2-methoxy-5-methylphenyl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide
CID 60615698
4-[cyclohexyl(methyl)sulfamoyl]-N-(5-fluoro-2-methylphenyl)benzamide
CID 60616670
4-[cyclopentyl(methyl)sulfamoyl]-N-naphthalen-1-ylbenzamide
CID 7656072
4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 7656046
3-[(4-acetamidobenzoyl)amino]-4-chloro-N,N-dimethylbenzamide
CID 38957858
4-[cyclopentyl(methyl)sulfamoyl]-N-(4,7-dichloro-1,3-benzothiazol-2-yl)benzamide
CID 43947389
4-[cyclopentyl(methyl)sulfamoyl]-N-(4-fluorophenyl)benzamide
CID 7656086
N-[2-chloro-5-(dimethylcarbamoyl)phenyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide
CID 38957548
4-[cyclopropyl(methyl)sulfamoyl]-N-(3,5-dimethylphenyl)benzamide
CID 41364081
4-[cyclohexyl(methyl)sulfamoyl]-N-[3-(methanesulfonamido)phenyl]benzamide
CID 43057657
4-[cyclohexyl(methyl)sulfamoyl]-N-(2-thiophen-2-ylphenyl)benzamide
CID 55469203

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide?
The IUPAC name of 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide (CID 43071932) is 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide?
The canonical SMILES for 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide is CN(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(S(=O)(=O)N(C)C3CCCCC3)cc2)c1.
What is the InChIKey of 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide?
The InChIKey is QIBYJMYLSPESRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28ClN3O4S/c1-26(2)23(29)17-11-14-20(24)21(15-17)25-22(28)16-9-12-19(13-10-16)32(30,31)27(3)18-7-5-4-6-8-18/h9-15,18H,4-8H2,1-3H3,(H,25,28).
What are the key properties of 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide?
4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide has a molecular weight of 478.01 g/mol, XLogP of 4.25, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 43071932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).