3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide

C21H20N2O3S — CID 109064666

IUPAC3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide
SMILESCN(Cc1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C21H20N2O3S/c1-23(16-17-9-4-2-5-10-17)27(25,26)20-14-8-11-18(15-20)21(24)22-19-12-6-3-7-13-19/h2-15H,16H2,1H3,(H,22,24)
InChIKeyUFSNMIPUVOUKLP-UHFFFAOYSA-N
MW380.47 g/mol
LogP3.76
Rot. Bonds6

About 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide

3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide (PubChem CID 109064666) has the molecular formula C21H20N2O3S and a molecular weight of 380.47 g/mol. Its IUPAC name is 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide.

Molecular Properties

Compound Name3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide
PubChem CID109064666
Molecular FormulaC21H20N2O3S
Molecular Weight380.47 g/mol
Exact Mass380.12
IUPAC Name3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide
SMILESCN(Cc1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C21H20N2O3S/c1-23(16-17-9-4-2-5-10-17)27(25,26)20-14-8-11-18(15-20)21(24)22-19-12-6-3-7-13-19/h2-15H,16H2,1H3,(H,22,24)
InChIKeyUFSNMIPUVOUKLP-UHFFFAOYSA-N
XLogP3.76
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.47
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[benzyl(methyl)sulfamoyl]phenyl]-3-(butanoylamino)benzamide
CID 1025638
3-[benzyl(methyl)sulfamoyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 109064674
4-[benzyl(methyl)sulfamoyl]-N-(3-fluorophenyl)benzamide
CID 23885342
3-[benzyl(methyl)sulfamoyl]-N-cyclohexylbenzamide
CID 109063417
N-(3-acetylphenyl)-5-[benzyl(methyl)sulfamoyl]-2-chlorobenzamide
CID 2404495
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-3-(2,5-dioxopyrrolidin-1-yl)benzamide
CID 31493862
4-[benzyl(methyl)sulfamoyl]-N-(3,5-dichlorophenyl)benzamide
CID 23825383
3-(dimethylsulfamoyl)-N-[3-(2-methylpropyl)phenyl]benzamide
CID 110425651
N-benzyl-N-methyl-3-(piperidine-1-carbonyl)benzenesulfonamide
CID 109063284
N-(3-hydroxyphenyl)-3-[methyl(propyl)sulfamoyl]benzamide
CID 27241907
3-[benzyl-(2-methoxyphenyl)sulfamoyl]-N-[4-(diethylamino)phenyl]benzamide
CID 2433943
methyl 3-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamoyl]-5-nitrobenzoate
CID 1241800

Frequently Asked Questions

What is the IUPAC name of 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide?
The IUPAC name of 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide (CID 109064666) is 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide.
What is the SMILES notation for 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide?
The canonical SMILES for 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide is CN(Cc1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide?
The InChIKey is UFSNMIPUVOUKLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3S/c1-23(16-17-9-4-2-5-10-17)27(25,26)20-14-8-11-18(15-20)21(24)22-19-12-6-3-7-13-19/h2-15H,16H2,1H3,(H,22,24).
What are the key properties of 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide?
3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide has a molecular weight of 380.47 g/mol, XLogP of 3.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[benzyl(methyl)sulfamoyl]-N-phenylbenzamide is sourced from PubChem (CID 109064666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).