3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide

C23H24N2O4S — CID 4802997

IUPAC3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide
SMILESCOc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NC(C)c3ccccc3)c2)cc1
InChIInChI=1S/C23H24N2O4S/c1-17(18-8-5-4-6-9-18)24-23(26)19-10-7-11-22(16-19)30(27,28)25(2)20-12-14-21(29-3)15-13-20/h4-17H,1-3H3,(H,24,26)
InChIKeyOQEBYSOSRXLRBI-UHFFFAOYSA-N
MW424.52 g/mol
LogP4.01
Rot. Bonds7

About 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide

3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide (PubChem CID 4802997) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide
PubChem CID4802997
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC Name3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide
SMILESCOc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NC(C)c3ccccc3)c2)cc1
InChIInChI=1S/C23H24N2O4S/c1-17(18-8-5-4-6-9-18)24-23(26)19-10-7-11-22(16-19)30(27,28)25(2)20-12-14-21(29-3)15-13-20/h4-17H,1-3H3,(H,24,26)
InChIKeyOQEBYSOSRXLRBI-UHFFFAOYSA-N
XLogP4.01
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(benzamidocarbamoyl)-N-(4-methoxyphenyl)-N-methylbenzenesulfonamide
CID 2572195
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-methylbenzamide
CID 51156149
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(2-phenylbutyl)benzamide
CID 46520973
N-[1-(5-chlorothiophen-2-yl)ethyl]-3-[(4-methoxyphenyl)-methylsulfamoyl]benzamide
CID 46415949
N-[1-(2,4-difluorophenyl)ethyl]-3-[(4-methoxyphenyl)-methylsulfamoyl]benzamide
CID 42907074
N-[(1R)-1-(4-methoxyphenyl)ethyl]-4-[(4-methoxyphenyl)sulfonyl-methylamino]benzamide
CID 92685580
N-[1-(dimethylamino)-3-phenylpropan-2-yl]-3-[(4-methoxyphenyl)-methylsulfamoyl]benzamide
CID 55952896
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-[2-(N-methylanilino)propyl]benzamide
CID 55708466
methyl 3-[(4-methoxyphenyl)-methylsulfamoyl]benzoate
CID 8871525
N-(3-aminobutyl)-3-[(4-methoxyphenyl)-methylsulfamoyl]benzamide
CID 119497549
3-[methyl(phenyl)sulfamoyl]-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide
CID 46436913
N-[1-(4-methoxyphenyl)ethyl]-3-(phenylsulfamoyl)benzamide
CID 132663597

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide?
The IUPAC name of 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide (CID 4802997) is 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide?
The canonical SMILES for 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide is COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NC(C)c3ccccc3)c2)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide?
The InChIKey is OQEBYSOSRXLRBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-17(18-8-5-4-6-9-18)24-23(26)19-10-7-11-22(16-19)30(27,28)25(2)20-12-14-21(29-3)15-13-20/h4-17H,1-3H3,(H,24,26).
What are the key properties of 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide?
3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide has a molecular weight of 424.52 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)-methylsulfamoyl]-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 4802997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).