5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide

C23H24N2O4S — CID 112771772

IUPAC5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CN(C)C(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cc1
InChIInChI=1S/C23H24N2O4S/c1-17-8-10-19(11-9-17)16-25(2)23(27)21-14-20(12-13-22(21)26)30(28,29)24-15-18-6-4-3-5-7-18/h3-14,24,26H,15-16H2,1-2H3
InChIKeyCJLXPOQVBDQKCN-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.45
Rot. Bonds7

About 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide

5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide (PubChem CID 112771772) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide.

Molecular Properties

Compound Name5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide
PubChem CID112771772
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC Name5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide
SMILESCc1ccc(CN(C)C(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cc1
InChIInChI=1S/C23H24N2O4S/c1-17-8-10-19(11-9-17)16-25(2)23(27)21-14-20(12-13-22(21)26)30(28,29)24-15-18-6-4-3-5-7-18/h3-14,24,26H,15-16H2,1-2H3
InChIKeyCJLXPOQVBDQKCN-UHFFFAOYSA-N
XLogP3.45
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(furan-2-ylmethylsulfamoyl)-N,2-dimethyl-N-[(4-methylphenyl)methyl]benzamide
CID 35155749
5-(benzylsulfamoyl)-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 4808865
N-benzyl-5-(ethylsulfamoyl)-2-methoxy-N-methylbenzamide
CID 19257900
N-[(1-benzylpyrazol-4-yl)methyl]-5-(benzylsulfamoyl)-N,2-dimethylbenzamide
CID 31798787
N-benzyl-N-methyl-2-[3-[(4-methylphenyl)sulfonylamino]propanoylamino]benzamide
CID 17154235
N-[2-[benzyl(methyl)amino]ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]benzamide
CID 20854214
N-benzyl-N-methyl-3-(pyridin-4-ylmethylsulfamoyl)benzamide
CID 109064677
2-methyl-5-[(4-methylphenyl)methylsulfamoyl]benzamide
CID 3439524
5-(cyclopropylsulfamoyl)-N,2-dimethyl-N-[(4-methylphenyl)methyl]benzamide
CID 18170187
2-[[5-(benzylsulfamoyl)-2-methylbenzoyl]-methylamino]propanoic acid
CID 119209339
5-(benzylsulfamoyl)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-methylbenzamide
CID 55638308
N-[(4-bromophenyl)methyl]-2-hydroxy-N,5-dimethylbenzamide
CID 42987430

Frequently Asked Questions

What is the IUPAC name of 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide?
The IUPAC name of 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide (CID 112771772) is 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide.
What is the SMILES notation for 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide?
The canonical SMILES for 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide is Cc1ccc(CN(C)C(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)cc1.
What is the InChIKey of 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide?
The InChIKey is CJLXPOQVBDQKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-17-8-10-19(11-9-17)16-25(2)23(27)21-14-20(12-13-22(21)26)30(28,29)24-15-18-6-4-3-5-7-18/h3-14,24,26H,15-16H2,1-2H3.
What are the key properties of 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide?
5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide has a molecular weight of 424.52 g/mol, XLogP of 3.45, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzylsulfamoyl)-2-hydroxy-N-methyl-N-[(4-methylphenyl)methyl]benzamide is sourced from PubChem (CID 112771772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).