Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate
TL;DR: Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate (CAS 21824-10-2) is a chemical compound with molecular formula C20H26N4O4S and molecular weight 418.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3-methyl-2-(quinoxaline-2-carbonylamino)butanoyl]amino]-4-methylsulfanylbutanoate
Also Known As: methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate, Methyl N-(quinoxaline-2-carbonyl)valylmethioninate, METHYL 2-[[3-METHYL-2-(QUINOXALINE-2-CARBONYLAMINO)BUTANOYL]AMINO]-4-METHYLSULFANYL-BUTANOATE, methyl 2-[[3-methyl-2-(quinoxaline-2-carbonylamino)butanoyl]amino]-4-methylsulfanylbutanoate
| Molecular Formula | C20H26N4O4S |
|---|---|
| Molecular Weight | 418.17 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 136.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 418.16748 |
| Heavy Atoms | 29 |
| Complexity | 575.0 |
Chemical Identifiers
| CAS Number | 21824-10-2 |
|---|---|
| SMILES | CC(C)C(C(=O)NC(CCSC)C(=O)OC)NC(=O)C1=NC2=CC=CC=C2N=C1 |
| InChIKey | BJHZNDPHTPPVMH-UHFFFAOYSA-N |
Product Overview
Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate (CAS 21824-10-2), with molecular formula C20H26N4O4S and molecular weight 418.17 g/mol. IUPAC: methyl 2-[[3-methyl-2-(quinoxaline-2-carbonylamino)butanoyl]amino]-4-methylsulfanylbutanoate.
Chemical Property Profile of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate
Property Insights of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate. The TPSA of 136.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate. Following Lipinski's Rule of Five, Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate has 2 hydrogen bond donor(s) and 7 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-(quinoxalin-2-ylcarbonyl)valylmethioninate?
The CAS number of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate is 21824-10-2.
What is the molecular formula of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate?
The molecular formula of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate is C20H26N4O4S.
What is the molecular weight of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate?
The molecular weight of Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate is 418.17 g/mol.
Where can I buy Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate?
You can request a quote for Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate?
Yes, KEHONG BIO provides custom synthesis services for Methyl n-(quinoxalin-2-ylcarbonyl)valylmethioninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.