N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide

C22H20F2N2O4S — CID 43030214

IUPACN-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide
SMILESCCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc(F)ccc3F)ccc2C)cc1
InChIInChI=1S/C22H20F2N2O4S/c1-3-30-18-9-7-16(8-10-18)26-31(28,29)21-13-17(6-4-14(21)2)25-22(27)19-12-15(23)5-11-20(19)24/h4-13,26H,3H2,1-2H3,(H,25,27)
InChIKeyXCWSFYXYABRWGP-UHFFFAOYSA-N
MW446.48 g/mol
LogP4.73
Rot. Bonds7

About N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide

N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide (PubChem CID 43030214) has the molecular formula C22H20F2N2O4S and a molecular weight of 446.48 g/mol. Its IUPAC name is N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide.

Molecular Properties

Compound NameN-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide
PubChem CID43030214
Molecular FormulaC22H20F2N2O4S
Molecular Weight446.48 g/mol
Exact Mass446.11
IUPAC NameN-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide
SMILESCCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc(F)ccc3F)ccc2C)cc1
InChIInChI=1S/C22H20F2N2O4S/c1-3-30-18-9-7-16(8-10-18)26-31(28,29)21-13-17(6-4-14(21)2)25-22(27)19-12-15(23)5-11-20(19)24/h4-13,26H,3H2,1-2H3,(H,25,27)
InChIKeyXCWSFYXYABRWGP-UHFFFAOYSA-N
XLogP4.73
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.48
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,5-difluoro-N-[4-methyl-3-[(3-methylphenyl)sulfamoyl]phenyl]benzamide
CID 30489963
N-(4-ethoxyphenyl)-5-[(4-fluorophenyl)sulfamoyl]-2-methylbenzamide
CID 26561579
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]thiophene-3-carboxamide
CID 30484505
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2-methyl-3-nitrobenzamide
CID 26852102
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-3-methylbut-2-enamide
CID 30877349
4-amino-N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]butanamide;hydrochloride
CID 119264847
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2-methylpent-2-enamide
CID 76870673
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 26852105
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-dioxo-1,6,7,8-tetrahydroquinoline-3-carboxamide
CID 36865808
3,4-difluoro-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]benzamide
CID 30451320
2-(4-cyanophenoxy)-N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]acetamide
CID 26852031
N-(4-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532343

Frequently Asked Questions

What is the IUPAC name of N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide?
The IUPAC name of N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide (CID 43030214) is N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide.
What is the SMILES notation for N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide?
The canonical SMILES for N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide is CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc(F)ccc3F)ccc2C)cc1.
What is the InChIKey of N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide?
The InChIKey is XCWSFYXYABRWGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20F2N2O4S/c1-3-30-18-9-7-16(8-10-18)26-31(28,29)21-13-17(6-4-14(21)2)25-22(27)19-12-15(23)5-11-20(19)24/h4-13,26H,3H2,1-2H3,(H,25,27).
What are the key properties of N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide?
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide has a molecular weight of 446.48 g/mol, XLogP of 4.73, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-2,5-difluorobenzamide is sourced from PubChem (CID 43030214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).