N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide

C17H24N4O4S — CID 3541908

IUPACN-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2nnc(C(C)(C)C)o2)cc1
InChIInChI=1S/C17H24N4O4S/c1-6-21(7-2)26(23,24)13-10-8-12(9-11-13)14(22)18-16-20-19-15(25-16)17(3,4)5/h8-11H,6-7H2,1-5H3,(H,18,20,22)
InChIKeyURTOVWLHRYZKQC-UHFFFAOYSA-N
MW380.47 g/mol
LogP2.65
Rot. Bonds6

About N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide

N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide (PubChem CID 3541908) has the molecular formula C17H24N4O4S and a molecular weight of 380.47 g/mol. Its IUPAC name is N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide
PubChem CID3541908
Molecular FormulaC17H24N4O4S
Molecular Weight380.47 g/mol
Exact Mass380.15
IUPAC NameN-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2nnc(C(C)(C)C)o2)cc1
InChIInChI=1S/C17H24N4O4S/c1-6-21(7-2)26(23,24)13-10-8-12(9-11-13)14(22)18-16-20-19-15(25-16)17(3,4)5/h8-11H,6-7H2,1-5H3,(H,18,20,22)
InChIKeyURTOVWLHRYZKQC-UHFFFAOYSA-N
XLogP2.65
TPSA105.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.47
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[benzyl(methyl)sulfamoyl]-N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)benzamide
CID 3353866
4-[bis(2-methoxyethyl)sulfamoyl]-N-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 5228772
4-(diethylsulfamoyl)-N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 2081481
N-tert-butyl-4-[[4-(diethylsulfamoyl)benzoyl]amino]benzamide
CID 38253660
N-[5-(1-benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]-4-(diethylsulfamoyl)benzamide
CID 40957473
N-(4-acetamidophenyl)-4-(diethylsulfamoyl)benzamide
CID 7940158
ethyl 4-[4-[(5-tert-butyl-1,3,4-oxadiazol-2-yl)carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate
CID 3437327
N-[5-(1,3-benzodioxol-5-ylmethyl)-1,3,4-oxadiazol-2-yl]-4-(diethylsulfamoyl)benzamide
CID 41179038
4-(diethylsulfamoyl)-N-[5-[(4-propan-2-ylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide
CID 43974528
4-[benzyl(ethyl)sulfamoyl]-N-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)benzamide
CID 2051211
4-(diethylsulfamoyl)-N-pyridin-2-ylbenzamide
CID 46671899
N-[4-(diethylsulfamoyl)phenyl]benzamide
CID 730591

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide?
The IUPAC name of N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide (CID 3541908) is N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide.
What is the SMILES notation for N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide?
The canonical SMILES for N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide is CCN(CC)S(=O)(=O)c1ccc(C(=O)Nc2nnc(C(C)(C)C)o2)cc1.
What is the InChIKey of N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide?
The InChIKey is URTOVWLHRYZKQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O4S/c1-6-21(7-2)26(23,24)13-10-8-12(9-11-13)14(22)18-16-20-19-15(25-16)17(3,4)5/h8-11H,6-7H2,1-5H3,(H,18,20,22).
What are the key properties of N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide?
N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide has a molecular weight of 380.47 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-4-(diethylsulfamoyl)benzamide is sourced from PubChem (CID 3541908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).