![methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate structure](/static/products/879/879576-77-9.png)
methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate
TL;DR: methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate (CAS 879576-77-9) is a chemical compound with molecular formula C13H15N3O4 and molecular weight 277.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]propanoate
Also Known As: methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate, methyl 3-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]propanoate, methyl 3-(3-oxo-1,2,3,4-tetrahydroquinoxaline-1-carboxamido)propanoate
| Molecular Formula | C13H15N3O4 |
|---|---|
| Molecular Weight | 277.11 g/mol |
| LogP | 0.7178 |
| Topological Polar Surface Area | 87.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.10626 |
| Heavy Atoms | 20 |
| Complexity | 544.1727 |
Chemical Identifiers
| CAS Number | 879576-77-9 |
|---|---|
| SMILES | COC(=O)CCNC(=O)N1CC(=O)NC2=CC=CC=C21 |
Product Overview
methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate (CAS 879576-77-9), with molecular formula C13H15N3O4 and molecular weight 277.11 g/mol. IUPAC: methyl 3-[(3-oxo-2,4-dihydroquinoxaline-1-carbonyl)amino]propanoate.
Chemical Property Profile of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate
Property Insights of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate
The XLogP value of 0.7178 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate. The TPSA of 87.74 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate. Following Lipinski's Rule of Five, methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate has 2 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 methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate?
The CAS number of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate is 879576-77-9.
What is the molecular formula of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate?
The molecular formula of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate is C13H15N3O4.
What is the molecular weight of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate?
The molecular weight of methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate is 277.11 g/mol.
Where can I buy methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate?
You can request a quote for methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[(3-hydroxyquinoxalin-1(2H)-yl)carbonyl]-beta-alaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.