4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide

C20H22N4O4S — CID 55700552

IUPAC4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1
InChIInChI=1S/C20H22N4O4S/c1-4-24(5-2)29(26,27)16-12-10-15(11-13-16)20(25)22-18-9-7-6-8-17(18)19-21-14(3)28-23-19/h6-13H,4-5H2,1-3H3,(H,22,25)
InChIKeyNOFRKMKVIUIAQQ-UHFFFAOYSA-N
MW414.49 g/mol
LogP3.33
Rot. Bonds7

About 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide

4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide (PubChem CID 55700552) has the molecular formula C20H22N4O4S and a molecular weight of 414.49 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
PubChem CID55700552
Molecular FormulaC20H22N4O4S
Molecular Weight414.49 g/mol
Exact Mass414.14
IUPAC Name4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1
InChIInChI=1S/C20H22N4O4S/c1-4-24(5-2)29(26,27)16-12-10-15(11-13-16)20(25)22-18-9-7-6-8-17(18)19-21-14(3)28-23-19/h6-13H,4-5H2,1-3H3,(H,22,25)
InChIKeyNOFRKMKVIUIAQQ-UHFFFAOYSA-N
XLogP3.33
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.49
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[methyl-(4-methylphenyl)sulfonylamino]-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 55700622
4-bromo-3-(dimethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide
CID 55700495
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide
CID 55765878
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591
4-(diethylsulfamoyl)-N-pyridin-2-ylbenzamide
CID 46671899
4-(dipropylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 3936209
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-2-[methyl(pyridin-3-ylsulfonyl)amino]acetamide
CID 55766151
4-[benzyl(ethyl)sulfamoyl]-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 109060838
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]-1,5-diphenyl-1,2,4-triazole-3-carboxamide
CID 55700588
N-(5-amino-2-methylphenyl)-4-(diethylsulfamoyl)benzamide
CID 28867137
N,N-diethyl-4-[[(4-methylbenzoyl)amino]carbamoyl]benzenesulfonamide
CID 2093173

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide (CID 55700552) is 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2ccccc2-c2noc(C)n2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
The InChIKey is NOFRKMKVIUIAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O4S/c1-4-24(5-2)29(26,27)16-12-10-15(11-13-16)20(25)22-18-9-7-6-8-17(18)19-21-14(3)28-23-19/h6-13H,4-5H2,1-3H3,(H,22,25).
What are the key properties of 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide?
4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide has a molecular weight of 414.49 g/mol, XLogP of 3.33, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]benzamide is sourced from PubChem (CID 55700552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).