methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate
TL;DR: methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate (CAS 325815-80-3) is a chemical compound with molecular formula C27H27N5O5S and molecular weight 533.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[N-acetyl-4-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]anilino]propanoate
Also Known As: methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate, methyl 3-[N-acetyl-4-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]anilino]propanoate, methyl N-acetyl-N-(4-{[(3Z)-3-{[(4-methylphenyl)sulfonyl]imino}-3,4-dihydroquinoxalin-2-yl]amino}phenyl)-beta-alaninate
| Molecular Formula | C27H27N5O5S |
|---|---|
| Molecular Weight | 533.17 g/mol |
| LogP | 4.39862 |
| Topological Polar Surface Area | 130.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 533.1733 |
| Heavy Atoms | 38 |
| Complexity | 1572.2961 |
Chemical Identifiers
| CAS Number | 325815-80-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=CC=C(C=C4)N(CCC(=O)OC)C(=O)C |
Product Overview
methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate (CAS 325815-80-3), with molecular formula C27H27N5O5S and molecular weight 533.17 g/mol. IUPAC: methyl 3-[N-acetyl-4-[[3-[(4-methylphenyl)sulfonylamino]quinoxalin-2-yl]amino]anilino]propanoate.
Chemical Property Profile of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate
Property Insights of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate
The XLogP value of 4.39862 indicates that methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.59 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate. Following Lipinski's Rule of Five, methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate?
The CAS number of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate is 325815-80-3.
What is the molecular formula of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate?
The molecular formula of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate is C27H27N5O5S.
What is the molecular weight of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate?
The molecular weight of methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate is 533.17 g/mol.
Where can I buy methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate?
You can request a quote for methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-(N-(4-((3-(4-methylphenylsulfonamido)quinoxalin-2-yl)amino)phenyl)acetamido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.