![5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione structure](/static/products/6262/626207-96-3.webp)
5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione
TL;DR: 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione (CAS 626207-96-3) is a chemical compound with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(4-methylphenoxy)methyl]-3H-1,3,4-oxadiazole-2-thione
Also Known As: 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione, 5-((p-Tolyloxy)methyl)-1,3,4-oxadiazole-2(3H)-thione, 5-[(4-methylphenoxy)methyl]-1,3,4-oxadiazole-2-thiol, BAS 01248445, 5-(4-methylphenoxymethyl)-2,3-dihydro-1,3,4-oxadiazole-2-thione
| Molecular Formula | C10H10N2O2S |
|---|---|
| Molecular Weight | 222.05 g/mol |
| LogP | 2.61961 |
| Topological Polar Surface Area | 51.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.0463 |
| Heavy Atoms | 15 |
| Complexity | 486.62354 |
Chemical Identifiers
| CAS Number | 626207-96-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC2=NNC(=S)O2 |
Product Overview
5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione (CAS 626207-96-3), with molecular formula C10H10N2O2S and molecular weight 222.05 g/mol. IUPAC: 5-[(4-methylphenoxy)methyl]-3H-1,3,4-oxadiazole-2-thione.
Chemical Property Profile of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione
Property Insights of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione
The XLogP value of 2.61961 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione. With a topological polar surface area (TPSA) of 51.05 Ų, 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione has 1 hydrogen bond donor(s) and 4 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-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione?
The CAS number of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione is 626207-96-3.
What is the molecular formula of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione?
The molecular formula of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione is C10H10N2O2S.
What is the molecular weight of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione?
The molecular weight of 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione is 222.05 g/mol.
Where can I buy 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione?
You can request a quote for 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-p-Tolyloxymethyl-3H-[1,3,4]oxadiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.