4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid
TL;DR: 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid (CAS 5182-95-6) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic acid
Also Known As: 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid, S-Ethyl-N-(quinoxaline-2-carbonyl)homocysteine
| Molecular Formula | C15H17N3O3S |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 1.956 |
| Topological Polar Surface Area | 92.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 319.09906 |
| Heavy Atoms | 22 |
| Complexity | 677.8852 |
Chemical Identifiers
| CAS Number | 5182-95-6 |
|---|---|
| SMILES | CCSCCC(C(=O)O)NC(=O)C1=NC2=CC=CC=C2N=C1 |
Product Overview
4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid (CAS 5182-95-6), with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol. IUPAC: 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic acid.
Chemical Property Profile of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid
Property Insights of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid
The XLogP value of 1.956 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid. The TPSA of 92.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid. Following Lipinski's Rule of Five, 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic 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 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid?
The CAS number of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid is 5182-95-6.
What is the molecular formula of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid?
The molecular formula of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid is C15H17N3O3S.
What is the molecular weight of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid?
The molecular weight of 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid is 319.10 g/mol.
Where can I buy 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid?
You can request a quote for 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-ethylsulfanyl-2-(quinoxaline-2-carbonylamino)butanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.