5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole
TL;DR: 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole (CAS 694455-63-5) is a chemical compound with molecular formula C14H11N3OS and molecular weight 269.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole
Also Known As: SDCCGMLS-0042452.P002, 5-(phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole, 3-{5-[(phenylsulfanyl)methyl]-1,2,4-oxadiazol-3-yl}pyridine, 3-{5-[(phenylthio)methyl]-1,2,4-oxadiazol-3-yl}pyridine
| Molecular Formula | C14H11N3OS |
|---|---|
| Molecular Weight | 269.06 g/mol |
| LogP | 3.4239 |
| Topological Polar Surface Area | 51.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.0623 |
| Heavy Atoms | 19 |
| Complexity | 640.0658 |
Chemical Identifiers
| CAS Number | 694455-63-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCC2=NC(=NO2)C3=CN=CC=C3 |
Product Overview
5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole (CAS 694455-63-5), with molecular formula C14H11N3OS and molecular weight 269.06 g/mol. IUPAC: 5-(phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole.
Chemical Property Profile of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole
Property Insights of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole
The XLogP value of 3.4239 indicates that 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.81 Ų, 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole has 0 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 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole?
The CAS number of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole is 694455-63-5.
What is the molecular formula of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole?
The molecular formula of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole is C14H11N3OS.
What is the molecular weight of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole?
The molecular weight of 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole is 269.06 g/mol.
Where can I buy 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole?
You can request a quote for 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(Phenylsulfanylmethyl)-3-pyridin-3-yl-1,2,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.