![allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate structure](/static/products/488/488796-71-0.png)
allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
TL;DR: allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 488796-71-0) is a chemical compound with molecular formula C22H21N5O4S and molecular weight 451.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 2-amino-1-[2-(4-sulfamoylphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, prop-2-enyl 2-amino-1-[2-(4-sulfamoylphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate, prop-2-en-1-yl 2-amino-1-[2-(4-sulfamoylphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
| Molecular Formula | C22H21N5O4S |
|---|---|
| Molecular Weight | 451.13 g/mol |
| LogP | 2.3996 |
| Topological Polar Surface Area | 143.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 451.13144 |
| Heavy Atoms | 32 |
| Complexity | 1442.9907 |
Chemical Identifiers
| CAS Number | 488796-71-0 |
|---|---|
| SMILES | C=CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC=C(C=C4)S(=O)(=O)N)N |
Product Overview
allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 488796-71-0), with molecular formula C22H21N5O4S and molecular weight 451.13 g/mol. IUPAC: prop-2-enyl 2-amino-1-[2-(4-sulfamoylphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Property Insights of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
The XLogP value of 2.3996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate. The TPSA of 143.19 Ų indicates high polarity, suggesting allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate 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 allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The CAS number of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 488796-71-0.
What is the molecular formula of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular formula of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is C22H21N5O4S.
What is the molecular weight of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular weight of allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 451.13 g/mol.
Where can I buy allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
You can request a quote for allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for allyl 2-amino-1-(4-sulfamoylphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.