N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide

C25H28N2O5S — CID 30874214

IUPACN-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide
SMILESCCOCc1ccc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(OCC)cc3)cc2)cc1
InChIInChI=1S/C25H28N2O5S/c1-3-31-18-20-7-5-19(6-8-20)17-26-25(28)21-9-15-24(16-10-21)33(29,30)27-22-11-13-23(14-12-22)32-4-2/h5-16,27H,3-4,17-18H2,1-2H3,(H,26,28)
InChIKeyWLZPPKCPJGFKPZ-UHFFFAOYSA-N
MW468.58 g/mol
LogP4.35
Rot. Bonds11

About N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide

N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide (PubChem CID 30874214) has the molecular formula C25H28N2O5S and a molecular weight of 468.58 g/mol. Its IUPAC name is N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide
PubChem CID30874214
Molecular FormulaC25H28N2O5S
Molecular Weight468.58 g/mol
Exact Mass468.17
IUPAC NameN-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide
SMILESCCOCc1ccc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(OCC)cc3)cc2)cc1
InChIInChI=1S/C25H28N2O5S/c1-3-31-18-20-7-5-19(6-8-20)17-26-25(28)21-9-15-24(16-10-21)33(29,30)27-22-11-13-23(14-12-22)32-4-2/h5-16,27H,3-4,17-18H2,1-2H3,(H,26,28)
InChIKeyWLZPPKCPJGFKPZ-UHFFFAOYSA-N
XLogP4.35
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.58
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(4-ethoxyphenyl)sulfamoyl]-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide
CID 55678008
4-ethoxy-N-[4-[[(2-phenylmethoxyacetyl)amino]carbamoyl]phenyl]benzenesulfonamide
CID 55359716
4-ethoxy-N-[[4-[[(4-ethoxybenzoyl)amino]methyl]phenyl]methyl]benzamide
CID 3528873
4-[(4-ethoxyphenyl)sulfamoyl]-N-prop-2-enylbenzamide
CID 9419122
4-[(4-ethoxyphenyl)sulfamoyl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 26775955
N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 30873016
N-[2-(diethylamino)ethyl]-4-[(4-ethoxyphenyl)sulfonylamino]benzamide
CID 4853767
2-[4-[(4-ethoxyphenyl)sulfamoyl]phenoxy]-N-[(4-methylphenyl)methyl]acetamide
CID 3943831
4-[(4-ethoxyphenyl)sulfonylamino]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120829034
4-[(4-ethoxyphenyl)sulfamoyl]-N-piperidin-1-ylbenzamide
CID 9271299
methyl 4-[[4-[(4-ethoxyphenyl)sulfamoyl]benzoyl]amino]butanoate
CID 18109760
4-ethoxy-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 4948543

Frequently Asked Questions

What is the IUPAC name of N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide?
The IUPAC name of N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide (CID 30874214) is N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide is CCOCc1ccc(CNC(=O)c2ccc(S(=O)(=O)Nc3ccc(OCC)cc3)cc2)cc1.
What is the InChIKey of N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide?
The InChIKey is WLZPPKCPJGFKPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O5S/c1-3-31-18-20-7-5-19(6-8-20)17-26-25(28)21-9-15-24(16-10-21)33(29,30)27-22-11-13-23(14-12-22)32-4-2/h5-16,27H,3-4,17-18H2,1-2H3,(H,26,28).
What are the key properties of N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide?
N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide has a molecular weight of 468.58 g/mol, XLogP of 4.35, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(ethoxymethyl)phenyl]methyl]-4-[(4-ethoxyphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 30874214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).