N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide

C15H14Cl2N2O3S — CID 31321210

IUPACN-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19-14-5-3-2-4-12(14)15(20)18-9-10-6-7-11(16)8-13(10)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyJETWTLYFLJDCPO-UHFFFAOYSA-N
MW373.26 g/mol
LogP3.29
Rot. Bonds5

About N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide

N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide (PubChem CID 31321210) has the molecular formula C15H14Cl2N2O3S and a molecular weight of 373.26 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide
PubChem CID31321210
Molecular FormulaC15H14Cl2N2O3S
Molecular Weight373.26 g/mol
Exact Mass372.01
IUPAC NameN-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide
SMILESCS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(Cl)cc1Cl
InChIInChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19-14-5-3-2-4-12(14)15(20)18-9-10-6-7-11(16)8-13(10)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyJETWTLYFLJDCPO-UHFFFAOYSA-N
XLogP3.29
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.26
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2,4-dichlorophenyl)methyl]-3-[[2-(methanesulfonamido)phenyl]methyl]-2-methylguanidine;hydroiodide
CID 111197571
N-[(2,4-dichlorophenyl)methyl]-2-[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethylamino]benzamide
CID 67131997
N-[(2,4-dichlorophenyl)methyl]-2,4,5-trimethylbenzamide
CID 100708024
2,4-dichloro-N-[2-(methanesulfonamido)phenyl]benzamide
CID 35368130
N-[(2,4-dichlorophenyl)methyl]-2-(2-methylsulfonylanilino)acetamide
CID 22304575
2-chloro-N-[2-[[N-[(2,4-dichlorophenyl)methyl]-N'-methylcarbamimidoyl]amino]ethyl]benzamide
CID 111198186
4-chloro-N-[(2,4-dichlorophenyl)methyl]-3-[(2-methylphenyl)sulfamoyl]benzamide
CID 3578493
3-[[2-(methanesulfonamido)benzoyl]amino]-2-methylpropanoic acid
CID 119237314
N-[(2,4-dichlorophenyl)methyl]-2,4-dimethylbenzamide
CID 2446682
2-(methanesulfonamido)-N-[(3-methylthiophen-2-yl)methyl]benzamide
CID 39584251
N-[(2,4-dichlorophenyl)methyl]-5-methylsulfonylthiophene-2-carboxamide
CID 162436580
2-chloro-N-[(2,4-dichlorophenyl)methyl]-5-[(4-methylphenyl)sulfonylamino]benzamide
CID 92682038

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide (CID 31321210) is N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide is CS(=O)(=O)Nc1ccccc1C(=O)NCc1ccc(Cl)cc1Cl.
What is the InChIKey of N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide?
The InChIKey is JETWTLYFLJDCPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19-14-5-3-2-4-12(14)15(20)18-9-10-6-7-11(16)8-13(10)17/h2-8,19H,9H2,1H3,(H,18,20).
What are the key properties of N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide?
N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide has a molecular weight of 373.26 g/mol, XLogP of 3.29, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methyl]-2-(methanesulfonamido)benzamide is sourced from PubChem (CID 31321210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).