![({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid structure](/static/products/7572/757220-90-9.webp)
({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid
TL;DR: ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid (CAS 757220-90-9) is a chemical compound with molecular formula C9H12N2O4S and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetic acid
Also Known As: 2-({1-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]ethyl}sulfanyl)acetic acid, ({1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid, 2-((1-((5-Methylisoxazol-3-yl)amino)-1-oxopropan-2-yl)thio)acetic acid, ([1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl]thio)acetic acid, 2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetic acid
| Molecular Formula | C9H12N2O4S |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 1.12782 |
| Topological Polar Surface Area | 92.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 244.05177 |
| Heavy Atoms | 16 |
| Complexity | 390.61563 |
Chemical Identifiers
| CAS Number | 757220-90-9 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)C(C)SCC(=O)O |
Product Overview
({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid (CAS 757220-90-9), with molecular formula C9H12N2O4S and molecular weight 244.05 g/mol. IUPAC: 2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetic acid.
Chemical Property Profile of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid
Property Insights of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid
The XLogP value of 1.12782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid. The TPSA of 92.43 Ų falls within the moderate polarity range, balancing permeability and solubility for ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid. Following Lipinski's Rule of Five, ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid has 2 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 ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid?
The CAS number of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid is 757220-90-9.
What is the molecular formula of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid?
The molecular formula of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid is C9H12N2O4S.
What is the molecular weight of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid?
The molecular weight of ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid is 244.05 g/mol.
Where can I buy ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid?
You can request a quote for ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for ({1-Methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxoethyl}thio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.