4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide

C23H24N2O3S — CID 92671538

IUPAC4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)c(C)c2)cc1
InChIInChI=1S/C23H24N2O3S/c1-17-9-11-19(12-10-17)16-25(3)23(26)20-13-14-22(18(2)15-20)24-29(27,28)21-7-5-4-6-8-21/h4-15,24H,16H2,1-3H3
InChIKeyLSCSSAYHHANEOZ-UHFFFAOYSA-N
MW408.52 g/mol
LogP4.38
Rot. Bonds6

About 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide

4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide (PubChem CID 92671538) has the molecular formula C23H24N2O3S and a molecular weight of 408.52 g/mol. Its IUPAC name is 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide
PubChem CID92671538
Molecular FormulaC23H24N2O3S
Molecular Weight408.52 g/mol
Exact Mass408.15
IUPAC Name4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)c(C)c2)cc1
InChIInChI=1S/C23H24N2O3S/c1-17-9-11-19(12-10-17)16-25(3)23(26)20-13-14-22(18(2)15-20)24-29(27,28)21-7-5-4-6-8-21/h4-15,24H,16H2,1-3H3
InChIKeyLSCSSAYHHANEOZ-UHFFFAOYSA-N
XLogP4.38
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.52
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,3-dimethyl-N-[(4-methylphenyl)methyl]-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 28570514
N-[(4-chlorophenyl)methyl]-N-methyl-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 27773866
N-benzyl-N,4-dimethyl-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 4042579
N-[(2,4-dimethylphenyl)methyl]-N-methyl-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 9227970
3-(benzenesulfonamido)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]benzamide
CID 38745291
4-[(2,4-dimethylphenyl)sulfamoyl]-N-methyl-N-phenylbenzamide
CID 109061718
3-benzamido-N,4-dimethyl-N-[(4-methylphenyl)methyl]benzamide
CID 46409799
4-(benzenesulfonamido)-N-[(4-fluorophenyl)methyl]-3-methylbenzamide
CID 30391889
4-chloro-N-[(4-chlorophenyl)methyl]-N-methyl-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 28568554
N-methyl-4-[(2-methylphenyl)sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 86976183
N-[(3,4-dimethoxyphenyl)methyl]-4-[(2-methoxyphenyl)sulfamoyl]-N-methylbenzamide
CID 26594486
N,3-dimethyl-4-[(4-methylphenyl)sulfonylamino]benzamide
CID 41465640

Frequently Asked Questions

What is the IUPAC name of 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide?
The IUPAC name of 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide (CID 92671538) is 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide.
What is the SMILES notation for 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide?
The canonical SMILES for 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide is Cc1ccc(CN(C)C(=O)c2ccc(NS(=O)(=O)c3ccccc3)c(C)c2)cc1.
What is the InChIKey of 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide?
The InChIKey is LSCSSAYHHANEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3S/c1-17-9-11-19(12-10-17)16-25(3)23(26)20-13-14-22(18(2)15-20)24-29(27,28)21-7-5-4-6-8-21/h4-15,24H,16H2,1-3H3.
What are the key properties of 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide?
4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide has a molecular weight of 408.52 g/mol, XLogP of 4.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzenesulfonamido)-N,3-dimethyl-N-[(4-methylphenyl)methyl]benzamide is sourced from PubChem (CID 92671538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).