N-Methyl-N-(quinoxaline-2-carbonyl)alanine
TL;DR: N-Methyl-N-(quinoxaline-2-carbonyl)alanine (CAS 5790-78-3) is a chemical compound with molecular formula C13H13N3O3 and molecular weight 259.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl(quinoxaline-2-carbonyl)amino]propanoic acid
Also Known As: 1,3,5-trinitro-[1,3,5]triazepane, n-methyl-n-(quinoxalin-2-ylcarbonyl)alanine, N-Methyl-N-(quinoxaline-2-carbonyl)alanine, 1,3,5-trinitro-hexahydro-[1,3,5]triazepine, 2-[methyl(quinoxaline-2-carbonyl)amino]propanoic acid
| Molecular Formula | C13H13N3O3 |
|---|---|
| Molecular Weight | 259.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.0957 |
| Heavy Atoms | 19 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 5790-78-3 |
|---|---|
| SMILES | CC(C(=O)O)N(C)C(=O)C1=NC2=CC=CC=C2N=C1 |
| InChIKey | QZTGAMKKSOLPRY-UHFFFAOYSA-N |
Product Overview
N-Methyl-N-(quinoxaline-2-carbonyl)alanine (CAS 5790-78-3), with molecular formula C13H13N3O3 and molecular weight 259.10 g/mol. IUPAC: 2-[methyl(quinoxaline-2-carbonyl)amino]propanoic acid.
Chemical Property Profile of N-Methyl-N-(quinoxaline-2-carbonyl)alanine
Property Insights of N-Methyl-N-(quinoxaline-2-carbonyl)alanine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-N-(quinoxaline-2-carbonyl)alanine. The TPSA of 83.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-N-(quinoxaline-2-carbonyl)alanine. Following Lipinski's Rule of Five, N-Methyl-N-(quinoxaline-2-carbonyl)alanine has 1 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 N-Methyl-N-(quinoxaline-2-carbonyl)alanine?
The CAS number of N-Methyl-N-(quinoxaline-2-carbonyl)alanine is 5790-78-3.
What is the molecular formula of N-Methyl-N-(quinoxaline-2-carbonyl)alanine?
The molecular formula of N-Methyl-N-(quinoxaline-2-carbonyl)alanine is C13H13N3O3.
What is the molecular weight of N-Methyl-N-(quinoxaline-2-carbonyl)alanine?
The molecular weight of N-Methyl-N-(quinoxaline-2-carbonyl)alanine is 259.10 g/mol.
Where can I buy N-Methyl-N-(quinoxaline-2-carbonyl)alanine?
You can request a quote for N-Methyl-N-(quinoxaline-2-carbonyl)alanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-N-(quinoxaline-2-carbonyl)alanine?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-N-(quinoxaline-2-carbonyl)alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.