![2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole structure](/static/products/6389/63892-74-0.webp)
2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole
TL;DR: 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole (CAS 63892-74-0) is a chemical compound with molecular formula C8H13NOS and molecular weight 171.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-4-(2-methylsulfanylethyl)-1,3-oxazole
Also Known As: 2,5-dimethyl-4-(2-methylsulfanylethyl)-1,3-oxazole, 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole, OXAZOLE,2,5-DIMETHYL-4-[2-(METHYLTHIO)ETHYL]-
| Molecular Formula | C8H13NOS |
|---|---|
| Molecular Weight | 171.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.0718 |
| Heavy Atoms | 11 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 63892-74-0 |
|---|---|
| SMILES | CC1=C(N=C(O1)C)CCSC |
| InChIKey | QWTQJJYBCFGVFP-UHFFFAOYSA-N |
Product Overview
2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole (CAS 63892-74-0), with molecular formula C8H13NOS and molecular weight 171.07 g/mol. IUPAC: 2,5-dimethyl-4-(2-methylsulfanylethyl)-1,3-oxazole.
Chemical Property Profile of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole
Property Insights of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole. With a topological polar surface area (TPSA) of 51.3 Ų, 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole has 0 hydrogen bond donor(s) and 3 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 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole?
The CAS number of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole is 63892-74-0.
What is the molecular formula of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole?
The molecular formula of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole is C8H13NOS.
What is the molecular weight of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole?
The molecular weight of 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole is 171.07 g/mol.
Where can I buy 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole?
You can request a quote for 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-4-[2-(methylsulfanyl)ethyl]-1,3-oxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.