3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide

C24H26N2O5S — CID 55991701

IUPAC3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc(C(=O)Nc3ccccc3OCC(C)C)c2)cc1
InChIInChI=1S/C24H26N2O5S/c1-17(2)16-31-23-10-5-4-9-22(23)25-24(27)18-7-6-8-21(15-18)32(28,29)26-19-11-13-20(30-3)14-12-19/h4-15,17,26H,16H2,1-3H3,(H,25,27)
InChIKeyFYCLFONLNVAMJY-UHFFFAOYSA-N
MW454.55 g/mol
LogP4.78
Rot. Bonds9

About 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide

3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide (PubChem CID 55991701) has the molecular formula C24H26N2O5S and a molecular weight of 454.55 g/mol. Its IUPAC name is 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide.

Molecular Properties

Compound Name3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide
PubChem CID55991701
Molecular FormulaC24H26N2O5S
Molecular Weight454.55 g/mol
Exact Mass454.16
IUPAC Name3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide
SMILESCOc1ccc(NS(=O)(=O)c2cccc(C(=O)Nc3ccccc3OCC(C)C)c2)cc1
InChIInChI=1S/C24H26N2O5S/c1-17(2)16-31-23-10-5-4-9-22(23)25-24(27)18-7-6-8-21(15-18)32(28,29)26-19-11-13-20(30-3)14-12-19/h4-15,17,26H,16H2,1-3H3,(H,25,27)
InChIKeyFYCLFONLNVAMJY-UHFFFAOYSA-N
XLogP4.78
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.55
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(2-methylpropoxy)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55989925
N-(2-methoxyphenyl)-3-[(2-methoxyphenyl)sulfamoyl]benzamide
CID 26538254
3-[(4-methoxyphenyl)sulfamoyl]-N-(3-methylbutyl)benzamide
CID 17480198
N-(2,5-dimethoxyphenyl)-3-[(4-fluorophenyl)sulfamoyl]benzamide
CID 94788763
N-(2-methoxyphenyl)-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7939173
4-[[3-[(4-methoxyphenyl)sulfamoyl]benzoyl]amino]benzoic acid
CID 6611513
N-(2,5-dimethoxyphenyl)-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 95254693
N-[2-(2-methylpropoxy)phenyl]-3-propan-2-yloxybenzamide
CID 17142483
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 4213453
N-methoxy-3-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 17421680
4-methoxy-N-[2-(2-methylpropoxy)phenyl]-3-(propan-2-ylsulfamoyl)benzamide
CID 55888443
3-methoxy-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 5156929

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide?
The IUPAC name of 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide (CID 55991701) is 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide.
What is the SMILES notation for 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide?
The canonical SMILES for 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide is COc1ccc(NS(=O)(=O)c2cccc(C(=O)Nc3ccccc3OCC(C)C)c2)cc1.
What is the InChIKey of 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide?
The InChIKey is FYCLFONLNVAMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O5S/c1-17(2)16-31-23-10-5-4-9-22(23)25-24(27)18-7-6-8-21(15-18)32(28,29)26-19-11-13-20(30-3)14-12-19/h4-15,17,26H,16H2,1-3H3,(H,25,27).
What are the key properties of 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide?
3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide has a molecular weight of 454.55 g/mol, XLogP of 4.78, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methoxyphenyl)sulfamoyl]-N-[2-(2-methylpropoxy)phenyl]benzamide is sourced from PubChem (CID 55991701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).