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

C17H16N4O4S — CID 154128118

IUPACN-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Cc2nc(-c3ccccc3S(N)(=O)=O)no2)cc1
InChIInChI=1S/C17H16N4O4S/c1-11(22)19-13-8-6-12(7-9-13)10-16-20-17(21-25-16)14-4-2-3-5-15(14)26(18,23)24/h2-9H,10H2,1H3,(H,19,22)(H2,18,23,24)
InChIKeyOJFNARHQNXXKMI-UHFFFAOYSA-N
MW372.41 g/mol
LogP1.93
Rot. Bonds5

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

N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide (PubChem CID 154128118) has the molecular formula C17H16N4O4S and a molecular weight of 372.41 g/mol. Its IUPAC name is N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide
PubChem CID154128118
Molecular FormulaC17H16N4O4S
Molecular Weight372.41 g/mol
Exact Mass372.09
IUPAC NameN-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Cc2nc(-c3ccccc3S(N)(=O)=O)no2)cc1
InChIInChI=1S/C17H16N4O4S/c1-11(22)19-13-8-6-12(7-9-13)10-16-20-17(21-25-16)14-4-2-3-5-15(14)26(18,23)24/h2-9H,10H2,1H3,(H,19,22)(H2,18,23,24)
InChIKeyOJFNARHQNXXKMI-UHFFFAOYSA-N
XLogP1.93
TPSA128.18 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.41
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide?
The IUPAC name of N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide (CID 154128118) is N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide is CC(=O)Nc1ccc(Cc2nc(-c3ccccc3S(N)(=O)=O)no2)cc1.
What is the InChIKey of N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide?
The InChIKey is OJFNARHQNXXKMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O4S/c1-11(22)19-13-8-6-12(7-9-13)10-16-20-17(21-25-16)14-4-2-3-5-15(14)26(18,23)24/h2-9H,10H2,1H3,(H,19,22)(H2,18,23,24).
What are the key properties of N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide?
N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide has a molecular weight of 372.41 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[3-(2-sulfamoylphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenyl]acetamide is sourced from PubChem (CID 154128118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).