2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole
TL;DR: 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole (CAS 899989-01-6) is a chemical compound with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethoxyphenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole
Also Known As: VU0497662-1, F2771-0074, 2-((3,5-dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole, 4-(5-{[(3,5-dimethoxyphenyl)methyl]sulfanyl}-1,3,4-oxadiazol-2-yl)pyridine, 2-[(3,5-dimethoxyphenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole
| Molecular Formula | C16H15N3O3S |
|---|---|
| Molecular Weight | 329.08 g/mol |
| LogP | 3.4411 |
| Topological Polar Surface Area | 70.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.0834 |
| Heavy Atoms | 23 |
| Complexity | 755.00146 |
Chemical Identifiers
| CAS Number | 899989-01-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)CSC2=NN=C(O2)C3=CC=NC=C3)OC |
Product Overview
2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole (CAS 899989-01-6), with molecular formula C16H15N3O3S and molecular weight 329.08 g/mol. IUPAC: 2-[(3,5-dimethoxyphenyl)methylsulfanyl]-5-pyridin-4-yl-1,3,4-oxadiazole.
Chemical Property Profile of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole
Property Insights of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole
The XLogP value of 3.4411 indicates that 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.27 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole. Following Lipinski's Rule of Five, 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole has 0 hydrogen bond donor(s) and 7 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 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole?
The CAS number of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole is 899989-01-6.
What is the molecular formula of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole?
The molecular formula of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole is C16H15N3O3S.
What is the molecular weight of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole?
The molecular weight of 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole is 329.08 g/mol.
Where can I buy 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole?
You can request a quote for 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,5-Dimethoxybenzyl)thio)-5-(pyridin-4-yl)-1,3,4-oxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.