3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
TL;DR: 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide (CAS 896344-89-1) is a chemical compound with molecular formula C16H13N3O2S and molecular weight 311.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylsulfanyl-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
Also Known As: 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide, 3-methylsulfanyl-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide, 3-(methylsulfanyl)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide, F2554-0248
| Molecular Formula | C16H13N3O2S |
|---|---|
| Molecular Weight | 311.07 g/mol |
| LogP | 3.7108 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.07285 |
| Heavy Atoms | 22 |
| Complexity | 786.84973 |
Chemical Identifiers
| CAS Number | 896344-89-1 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)C(=O)NC2=NN=C(O2)C3=CC=CC=C3 |
Product Overview
3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide (CAS 896344-89-1), with molecular formula C16H13N3O2S and molecular weight 311.07 g/mol. IUPAC: 3-methylsulfanyl-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide.
Chemical Property Profile of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
Property Insights of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide
The XLogP value of 3.7108 indicates that 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The CAS number of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is 896344-89-1.
What is the molecular formula of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The molecular formula of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is C16H13N3O2S.
What is the molecular weight of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
The molecular weight of 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide is 311.07 g/mol.
Where can I buy 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
You can request a quote for 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(methylthio)-N-(5-phenyl-1,3,4-oxadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.