4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide

C18H22N2O4S2 — CID 119099304

IUPAC4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NC2(c3cccs3)CCOCC2)cc1
InChIInChI=1S/C18H22N2O4S2/c1-20(2)26(22,23)15-7-5-14(6-8-15)17(21)19-18(9-11-24-12-10-18)16-4-3-13-25-16/h3-8,13H,9-12H2,1-2H3,(H,19,21)
InChIKeyFAXDQHLFMMWJGD-UHFFFAOYSA-N
MW394.52 g/mol
LogP2.43
Rot. Bonds5

About 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide

4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide (PubChem CID 119099304) has the molecular formula C18H22N2O4S2 and a molecular weight of 394.52 g/mol. Its IUPAC name is 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide.

Molecular Properties

Compound Name4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide
PubChem CID119099304
Molecular FormulaC18H22N2O4S2
Molecular Weight394.52 g/mol
Exact Mass394.10
IUPAC Name4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide
SMILESCN(C)S(=O)(=O)c1ccc(C(=O)NC2(c3cccs3)CCOCC2)cc1
InChIInChI=1S/C18H22N2O4S2/c1-20(2)26(22,23)15-7-5-14(6-8-15)17(21)19-18(9-11-24-12-10-18)16-4-3-13-25-16/h3-8,13H,9-12H2,1-2H3,(H,19,21)
InChIKeyFAXDQHLFMMWJGD-UHFFFAOYSA-N
XLogP2.43
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide?
The IUPAC name of 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide (CID 119099304) is 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide.
What is the SMILES notation for 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide?
The canonical SMILES for 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide is CN(C)S(=O)(=O)c1ccc(C(=O)NC2(c3cccs3)CCOCC2)cc1.
What is the InChIKey of 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide?
The InChIKey is FAXDQHLFMMWJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S2/c1-20(2)26(22,23)15-7-5-14(6-8-15)17(21)19-18(9-11-24-12-10-18)16-4-3-13-25-16/h3-8,13H,9-12H2,1-2H3,(H,19,21).
What are the key properties of 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide?
4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide has a molecular weight of 394.52 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylsulfamoyl)-N-(4-thiophen-2-yloxan-4-yl)benzamide is sourced from PubChem (CID 119099304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).