4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide

C21H16N2O3S — CID 153381057

IUPAC4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(-c2ccccc2)on1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H16N2O3S/c24-27(25,19-13-11-17(12-14-19)16-7-3-1-4-8-16)23-21-15-20(26-22-21)18-9-5-2-6-10-18/h1-15H,(H,22,23)
InChIKeyNKEZITHXSAJDDK-UHFFFAOYSA-N
MW376.44 g/mol
LogP4.81
Rot. Bonds5

About 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide

4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide (PubChem CID 153381057) has the molecular formula C21H16N2O3S and a molecular weight of 376.44 g/mol. Its IUPAC name is 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide
PubChem CID153381057
Molecular FormulaC21H16N2O3S
Molecular Weight376.44 g/mol
Exact Mass376.09
IUPAC Name4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1cc(-c2ccccc2)on1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H16N2O3S/c24-27(25,19-13-11-17(12-14-19)16-7-3-1-4-8-16)23-21-15-20(26-22-21)18-9-5-2-6-10-18/h1-15H,(H,22,23)
InChIKeyNKEZITHXSAJDDK-UHFFFAOYSA-N
XLogP4.81
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-phenyl-N-(4-phenylthiophen-3-yl)benzenesulfonamide
CID 10237527
4-phenyl-N-(4-phenyl-1,3-thiazol-2-yl)benzenesulfonamide
CID 10222134
N-(5-iodo-2-pyridinyl)-4-(5-phenyl-1,3-oxazol-2-yl)benzenesulfonamide
CID 19258782
4-butan-2-yl-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]benzenesulfonamide
CID 47093279
4-N-(4-phenylphenyl)benzene-1,4-disulfonamide
CID 8822463
CID 57350054
CID 57350054
4-bromo-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide
CID 670321
N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 16804909
4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]-N-phenylbenzamide
CID 109061637
4-(3-methyl-1,2-oxazol-5-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzenesulfonamide
CID 20917438
(5-phenyl-1,2-oxazol-3-yl)methyl 4-(propan-2-ylsulfamoyl)benzoate
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N-benzhydryl-4-phenylbenzenesulfonamide
CID 3504321

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
The IUPAC name of 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide (CID 153381057) is 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
The canonical SMILES for 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide is O=S(=O)(Nc1cc(-c2ccccc2)on1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
The InChIKey is NKEZITHXSAJDDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O3S/c24-27(25,19-13-11-17(12-14-19)16-7-3-1-4-8-16)23-21-15-20(26-22-21)18-9-5-2-6-10-18/h1-15H,(H,22,23).
What are the key properties of 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide?
4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide has a molecular weight of 376.44 g/mol, XLogP of 4.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(5-phenyl-1,2-oxazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 153381057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).