4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide

C24H24ClN3O4S — CID 55807376

IUPAC4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C24H24ClN3O4S/c1-16(2)26-24(30)21-14-11-18(25)15-22(21)27-23(29)17-9-12-20(13-10-17)33(31,32)28(3)19-7-5-4-6-8-19/h4-16H,1-3H3,(H,26,30)(H,27,29)
InChIKeyIDDMUHNSDGTBGD-UHFFFAOYSA-N
MW485.99 g/mol
LogP4.56
Rot. Bonds7

About 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide

4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide (PubChem CID 55807376) has the molecular formula C24H24ClN3O4S and a molecular weight of 485.99 g/mol. Its IUPAC name is 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide
PubChem CID55807376
Molecular FormulaC24H24ClN3O4S
Molecular Weight485.99 g/mol
Exact Mass485.12
IUPAC Name4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C24H24ClN3O4S/c1-16(2)26-24(30)21-14-11-18(25)15-22(21)27-23(29)17-9-12-20(13-10-17)33(31,32)28(3)19-7-5-4-6-8-19/h4-16H,1-3H3,(H,26,30)(H,27,29)
InChIKeyIDDMUHNSDGTBGD-UHFFFAOYSA-N
XLogP4.56
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.99
LogP ≤ 54.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-chlorophenyl)ethyl]-4-[methyl(phenyl)sulfamoyl]benzamide
CID 112761400
4-chloro-2-[(4-fluorobenzoyl)amino]-N-propan-2-ylbenzamide
CID 24662064
N-(5-chloro-2-morpholin-4-ylphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 4801212
4-[(4-chlorophenyl)sulfonyl-methylamino]-N-(2-ethylphenyl)benzamide
CID 1289635
N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 18126261
N-(2,5-dichlorophenyl)-4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 1265291
N-(2,5-dichlorophenyl)-3-[methyl(phenyl)sulfamoyl]benzamide
CID 42991866
2-[[4-[benzenesulfonyl(methyl)amino]benzoyl]amino]-N-butan-2-ylbenzamide
CID 2943385
N-(5-chloro-2-methylphenyl)-4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 1255251
N-(4-bromo-2-fluorophenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2711561
N-butan-2-yl-2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzamide
CID 2947855
4-[(4-chlorophenyl)sulfonyl-methylamino]-N-[(1R)-1-phenylpropyl]benzamide
CID 92683507

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide?
The IUPAC name of 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide (CID 55807376) is 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide.
What is the SMILES notation for 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide?
The canonical SMILES for 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1.
What is the InChIKey of 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide?
The InChIKey is IDDMUHNSDGTBGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN3O4S/c1-16(2)26-24(30)21-14-11-18(25)15-22(21)27-23(29)17-9-12-20(13-10-17)33(31,32)28(3)19-7-5-4-6-8-19/h4-16H,1-3H3,(H,26,30)(H,27,29).
What are the key properties of 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide?
4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide has a molecular weight of 485.99 g/mol, XLogP of 4.56, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-propan-2-ylbenzamide is sourced from PubChem (CID 55807376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).