3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide

C23H24N2O4S — CID 35810494

IUPAC3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H24N2O4S/c1-29-16-15-24-23(26)20-11-8-14-22(17-20)30(27,28)25(21-12-6-3-7-13-21)18-19-9-4-2-5-10-19/h2-14,17H,15-16,18H2,1H3,(H,24,26)
InChIKeyZKYHUEQDNBPOBB-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.46
Rot. Bonds9

About 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide

3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide (PubChem CID 35810494) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
PubChem CID35810494
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC Name3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)c1
InChIInChI=1S/C23H24N2O4S/c1-29-16-15-24-23(26)20-11-8-14-22(17-20)30(27,28)25(21-12-6-3-7-13-21)18-19-9-4-2-5-10-19/h2-14,17H,15-16,18H2,1H3,(H,24,26)
InChIKeyZKYHUEQDNBPOBB-UHFFFAOYSA-N
XLogP3.46
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[benzyl(phenyl)sulfamoyl]-N-methoxybenzamide
CID 33098006
3-[benzyl-(2-chlorophenyl)sulfamoyl]-N-(3-methoxypropyl)benzamide
CID 2538961
3-[ethyl-(3-methylphenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 109063706
3-[ethyl(phenyl)sulfamoyl]-N-(2-phenoxyethyl)benzamide
CID 32933570
3-[ethyl(phenyl)sulfamoyl]-N-[3-(2-phenylethoxy)propyl]benzamide
CID 55889436
3-[(3-chlorophenyl)-methylsulfamoyl]-N-(2-methoxyethyl)benzamide
CID 27659280
4-[[N-(benzenesulfonyl)anilino]methyl]-N-propylbenzamide
CID 4239264
[2-(ethylamino)-2-oxoethyl] 3-[benzyl(phenyl)sulfamoyl]benzoate
CID 2610488
3-N-benzyl-1-N-(2-methoxyethyl)-3-N-methylbenzene-1,3-dicarboxamide
CID 109052503
N-(2-phenylethyl)-3-[phenyl(prop-2-enyl)sulfamoyl]benzamide
CID 16547658
N-(3-aminopropyl)-3-[ethyl(phenyl)sulfamoyl]benzamide
CID 119405879
N-(2-methoxyethyl)-3-(phenylsulfamoyl)benzamide
CID 19257386

Frequently Asked Questions

What is the IUPAC name of 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
The IUPAC name of 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide (CID 35810494) is 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1cccc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)c1.
What is the InChIKey of 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
The InChIKey is ZKYHUEQDNBPOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-29-16-15-24-23(26)20-11-8-14-22(17-20)30(27,28)25(21-12-6-3-7-13-21)18-19-9-4-2-5-10-19/h2-14,17H,15-16,18H2,1H3,(H,24,26).
What are the key properties of 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide?
3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide has a molecular weight of 424.52 g/mol, XLogP of 3.46, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[benzyl(phenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 35810494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).