![ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate structure](/static/products/836/836633-30-8.png)
ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate
TL;DR: ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate (CAS 836633-30-8) is a chemical compound with molecular formula C27H22ClN5O3 and molecular weight 499.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-amino-3-[(2-chlorophenyl)methylcarbamoyl]pyrrolo[3,2-b]quinoxalin-1-yl]benzoate
Also Known As: ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate, ethyl 4-[2-amino-3-[(2-chlorophenyl)methylcarbamoyl]pyrrolo[3,2-b]quinoxalin-1-yl]benzoate, ethyl 4-{2-amino-3-[(2-chlorobenzyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}benzoate
| Molecular Formula | C27H22ClN5O3 |
|---|---|
| Molecular Weight | 499.14 g/mol |
| LogP | 4.916 |
| Topological Polar Surface Area | 112.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 499.1411 |
| Heavy Atoms | 36 |
| Complexity | 1611.9347 |
Chemical Identifiers
| CAS Number | 836633-30-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=CC=C5Cl)N |
Product Overview
ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate (CAS 836633-30-8), with molecular formula C27H22ClN5O3 and molecular weight 499.14 g/mol. IUPAC: ethyl 4-[2-amino-3-[(2-chlorophenyl)methylcarbamoyl]pyrrolo[3,2-b]quinoxalin-1-yl]benzoate.
Chemical Property Profile of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate
Property Insights of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate
The XLogP value of 4.916 indicates that ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate. Following Lipinski's Rule of Five, ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate has 2 hydrogen bond donor(s) and 6 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-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
The CAS number of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is 836633-30-8.
What is the molecular formula of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
The molecular formula of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is C27H22ClN5O3.
What is the molecular weight of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
The molecular weight of ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is 499.14 g/mol.
Where can I buy ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
You can request a quote for ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)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-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-amino-3-((2-chlorobenzyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.