![2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid structure](/static/products/4468/446830-00-8.webp)
2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid
TL;DR: 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid (CAS 446830-00-8) is a chemical compound with molecular formula C8H11NO3S and molecular weight 201.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetic acid
Also Known As: ([(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]THIO)ACETIC ACID, 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetic Acid, {[(3,5-dimethylisoxazol-4-yl)methyl]thio}acetic acid, [[(3,5-DIMETHYLISOXAZOL-4-YL)METHYL]THIO]ACETIC ACID, 2-{[(dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid
| Molecular Formula | C8H11NO3S |
|---|---|
| Molecular Weight | 201.05 g/mol |
| LogP | 1.60924 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 201.04596 |
| Heavy Atoms | 13 |
| Complexity | 288.83783 |
Chemical Identifiers
| CAS Number | 446830-00-8 |
|---|---|
| SMILES | CC1=C(C(=NO1)C)CSCC(=O)O |
Product Overview
2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid (CAS 446830-00-8), with molecular formula C8H11NO3S and molecular weight 201.05 g/mol. IUPAC: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetic acid.
Chemical Property Profile of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid
Property Insights of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid
The XLogP value of 1.60924 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid. Following Lipinski's Rule of Five, 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid 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 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid?
The CAS number of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid is 446830-00-8.
What is the molecular formula of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid?
The molecular formula of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid is C8H11NO3S.
What is the molecular weight of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid?
The molecular weight of 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid is 201.05 g/mol.
Where can I buy 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid?
You can request a quote for 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(Dimethyl-1,2-oxazol-4-yl)methyl]sulfanyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.