2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide

C22H22N2O4S — CID 8752850

IUPAC2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
SMILESCC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Oc2ccccc2)cc1
InChIInChI=1S/C22H22N2O4S/c1-16(2)24-29(26,27)19-14-12-17(13-15-19)23-22(25)20-10-6-7-11-21(20)28-18-8-4-3-5-9-18/h3-16,24H,1-2H3,(H,23,25)
InChIKeySGDXQEZSHBTEEA-UHFFFAOYSA-N
MW410.50 g/mol
LogP4.42
Rot. Bonds7

About 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide

2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide (PubChem CID 8752850) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide.

Molecular Properties

Compound Name2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
PubChem CID8752850
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC Name2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
SMILESCC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Oc2ccccc2)cc1
InChIInChI=1S/C22H22N2O4S/c1-16(2)24-29(26,27)19-14-12-17(13-15-19)23-22(25)20-10-6-7-11-21(20)28-18-8-4-3-5-9-18/h3-16,24H,1-2H3,(H,23,25)
InChIKeySGDXQEZSHBTEEA-UHFFFAOYSA-N
XLogP4.42
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 54.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-phenoxy-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]benzamide
CID 1164331
2-(2-phenylethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 19628144
3-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 8752814
2-phenoxy-N-phenylbenzamide
CID 3402306
N-[4-(diethylsulfamoyl)phenyl]-2-phenoxybenzamide
CID 1214319
2-phenoxy-N-(4-phenylphenyl)benzamide
CID 7926007
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 42999581
N-(4-acetylphenyl)-2-phenoxybenzamide
CID 2476949
2-(2-methylpropoxy)-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 4945295
2,2-diphenyl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 1263402
2-methoxy-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
CID 1226628
2-ethoxy-N-[3-methyl-1-oxo-1-[4-(propan-2-ylsulfamoyl)anilino]butan-2-yl]benzamide
CID 24635375

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
The IUPAC name of 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide (CID 8752850) is 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide.
What is the SMILES notation for 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
The canonical SMILES for 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide is CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccccc2Oc2ccccc2)cc1.
What is the InChIKey of 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
The InChIKey is SGDXQEZSHBTEEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-16(2)24-29(26,27)19-14-12-17(13-15-19)23-22(25)20-10-6-7-11-21(20)28-18-8-4-3-5-9-18/h3-16,24H,1-2H3,(H,23,25).
What are the key properties of 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide?
2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide has a molecular weight of 410.50 g/mol, XLogP of 4.42, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide is sourced from PubChem (CID 8752850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).