![Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate structure](/static/products/2178/21785-41-1.webp)
Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate
TL;DR: Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate (CAS 21785-41-1) is a chemical compound with molecular formula C18H22N4O4 and molecular weight 358.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate
Also Known As: methyl n-(quinoxalin-2-ylcarbonyl)alanylvalinate, methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate, N-{1-Hydroxy-1-[(1-methoxy-3-methyl-1-oxobutan-2-yl)imino]propan-2-yl}quinoxaline-2-carboximidic acid
| Molecular Formula | C18H22N4O4 |
|---|---|
| Molecular Weight | 358.16 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.1641 |
| Heavy Atoms | 26 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 21785-41-1 |
|---|---|
| SMILES | CC(C)C(C(=O)OC)NC(=O)C(C)NC(=O)C1=NC2=CC=CC=C2N=C1 |
| InChIKey | KCGVZEMKIYGFGP-UHFFFAOYSA-N |
Product Overview
Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate (CAS 21785-41-1), with molecular formula C18H22N4O4 and molecular weight 358.16 g/mol. IUPAC: methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate.
Chemical Property Profile of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate
Property Insights of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate. Following Lipinski's Rule of Five, Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate has 2 hydrogen bond donor(s) and 6 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 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate?
The CAS number of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate is 21785-41-1.
What is the molecular formula of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate?
The molecular formula of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate is C18H22N4O4.
What is the molecular weight of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate?
The molecular weight of Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate is 358.16 g/mol.
Where can I buy Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate?
You can request a quote for Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methyl-2-[2-(quinoxaline-2-carbonylamino)propanoylamino]butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.