N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide

C20H18N2O4S — CID 18126261

IUPACN-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
SMILESCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2O)cc1
InChIInChI=1S/C20H18N2O4S/c1-22(16-7-3-2-4-8-16)27(25,26)17-13-11-15(12-14-17)20(24)21-18-9-5-6-10-19(18)23/h2-14,23H,1H3,(H,21,24)
InChIKeyQZXABVARTABMGO-UHFFFAOYSA-N
MW382.44 g/mol
LogP3.47
Rot. Bonds5

About N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide

N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide (PubChem CID 18126261) has the molecular formula C20H18N2O4S and a molecular weight of 382.44 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
PubChem CID18126261
Molecular FormulaC20H18N2O4S
Molecular Weight382.44 g/mol
Exact Mass382.10
IUPAC NameN-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
SMILESCN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2O)cc1
InChIInChI=1S/C20H18N2O4S/c1-22(16-7-3-2-4-8-16)27(25,26)17-13-11-15(12-14-17)20(24)21-18-9-5-6-10-19(18)23/h2-14,23H,1H3,(H,21,24)
InChIKeyQZXABVARTABMGO-UHFFFAOYSA-N
XLogP3.47
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-tert-butylphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 7920184
N-(4-iodophenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2710071
2-[[4-[benzenesulfonyl(methyl)amino]benzoyl]amino]benzoic acid
CID 1339367
4-methyl-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
CID 1226832
N-(4-acetylphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2597397
2-[[4-[benzenesulfonyl(methyl)amino]benzoyl]amino]benzamide
CID 17201011
4-[benzenesulfonyl(methyl)amino]-N-(2-propan-2-ylphenyl)benzamide
CID 126140576
N-(4-bromo-2-fluorophenyl)-4-[methyl(phenyl)sulfamoyl]benzamide
CID 2711561
2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]-N-prop-2-enylbenzamide
CID 55413423
N-(2-acetylphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 26067652
N-(2-methoxyphenyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide
CID 1312611
4-[(4-chlorophenyl)sulfonyl-methylamino]-N-(2-ethylphenyl)benzamide
CID 1289635

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide (CID 18126261) is N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide is CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2O)cc1.
What is the InChIKey of N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide?
The InChIKey is QZXABVARTABMGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O4S/c1-22(16-7-3-2-4-8-16)27(25,26)17-13-11-15(12-14-17)20(24)21-18-9-5-6-10-19(18)23/h2-14,23H,1H3,(H,21,24).
What are the key properties of N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide?
N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide has a molecular weight of 382.44 g/mol, XLogP of 3.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-4-[methyl(phenyl)sulfamoyl]benzamide is sourced from PubChem (CID 18126261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).