ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate
TL;DR: ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate (CAS 797798-66-4) is a chemical compound with molecular formula C28H25N5O4 and molecular weight 495.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[2-amino-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]benzoate
Also Known As: ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate, ethyl 4-({[2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxalin-3-yl]carbonyl}amino)benzoate, ethyl 4-[[2-amino-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]benzoate
| Molecular Formula | C28H25N5O4 |
|---|---|
| Molecular Weight | 495.19 g/mol |
| LogP | 4.6526 |
| Topological Polar Surface Area | 121.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 495.19064 |
| Heavy Atoms | 37 |
| Complexity | 1608.5919 |
Chemical Identifiers
| CAS Number | 797798-66-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)CC5=CC=C(C=C5)OC)N |
Product Overview
ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate (CAS 797798-66-4), with molecular formula C28H25N5O4 and molecular weight 495.19 g/mol. IUPAC: ethyl 4-[[2-amino-1-[(4-methoxyphenyl)methyl]pyrrolo[3,2-b]quinoxaline-3-carbonyl]amino]benzoate.
Chemical Property Profile of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate
Property Insights of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate
The XLogP value of 4.6526 indicates that ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.36 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate. Following Lipinski's Rule of Five, ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate 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 ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate?
The CAS number of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate is 797798-66-4.
What is the molecular formula of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate?
The molecular formula of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate is C28H25N5O4.
What is the molecular weight of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate?
The molecular weight of ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate is 495.19 g/mol.
Where can I buy ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate?
You can request a quote for ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-amino-1-(4-methoxybenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.