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

C19H20N4O4S — CID 30870727

IUPAC4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cccc(-c3nnco3)c2)cc1
InChIInChI=1S/C19H20N4O4S/c1-3-23(4-2)28(25,26)17-10-8-14(9-11-17)18(24)21-16-7-5-6-15(12-16)19-22-20-13-27-19/h5-13H,3-4H2,1-2H3,(H,21,24)
InChIKeyMYAWKXOGTAOMKE-UHFFFAOYSA-N
MW400.46 g/mol
LogP3.02
Rot. Bonds7

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

4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide (PubChem CID 30870727) has the molecular formula C19H20N4O4S and a molecular weight of 400.46 g/mol. Its IUPAC name is 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide
PubChem CID30870727
Molecular FormulaC19H20N4O4S
Molecular Weight400.46 g/mol
Exact Mass400.12
IUPAC Name4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cccc(-c3nnco3)c2)cc1
InChIInChI=1S/C19H20N4O4S/c1-3-23(4-2)28(25,26)17-10-8-14(9-11-17)18(24)21-16-7-5-6-15(12-16)19-22-20-13-27-19/h5-13H,3-4H2,1-2H3,(H,21,24)
InChIKeyMYAWKXOGTAOMKE-UHFFFAOYSA-N
XLogP3.02
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.46
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-morpholin-4-ylsulfonyl-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide
CID 30823369
methyl 3-[[4-(diethylsulfamoyl)benzoyl]amino]benzoate
CID 2676516
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
4-(diethylsulfamoyl)-N-(3-ethynylphenyl)benzamide
CID 36666715
4-(diethylsulfamoyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 2666437
4-acetamido-N-[3-(diethylsulfamoyl)phenyl]benzamide
CID 7760016
N-(1,3-benzodioxol-5-yl)-4-(diethylsulfamoyl)benzamide
CID 2582581
5-chloro-6-ethoxy-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]pyridine-3-carboxamide
CID 71931594
[4-(1,3,4-oxadiazol-2-yl)phenyl] 3-(diethylsulfamoyl)benzoate
CID 16551650
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591
2-chloro-4-[[4-(diethylsulfamoyl)benzoyl]amino]benzamide
CID 39171138

Frequently Asked Questions

What is the IUPAC name of 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide?
The IUPAC name of 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide (CID 30870727) is 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide.
What is the SMILES notation for 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide?
The canonical SMILES for 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2cccc(-c3nnco3)c2)cc1.
What is the InChIKey of 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide?
The InChIKey is MYAWKXOGTAOMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4S/c1-3-23(4-2)28(25,26)17-10-8-14(9-11-17)18(24)21-16-7-5-6-15(12-16)19-22-20-13-27-19/h5-13H,3-4H2,1-2H3,(H,21,24).
What are the key properties of 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide?
4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide has a molecular weight of 400.46 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylsulfamoyl)-N-[3-(1,3,4-oxadiazol-2-yl)phenyl]benzamide is sourced from PubChem (CID 30870727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).