![tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate structure](/static/products/840/840456-47-5.png)
tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
TL;DR: tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 840456-47-5) is a chemical compound with molecular formula C23H23ClN4O4 and molecular weight 454.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate
| Molecular Formula | C23H23ClN4O4 |
|---|---|
| Molecular Weight | 454.14 g/mol |
| LogP | 4.7818 |
| Topological Polar Surface Area | 101.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.14078 |
| Heavy Atoms | 32 |
| Complexity | 1358.1104 |
Chemical Identifiers
| CAS Number | 840456-47-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4OC)OC)Cl)N |
Product Overview
tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 840456-47-5), with molecular formula C23H23ClN4O4 and molecular weight 454.14 g/mol. IUPAC: tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)pyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Property Insights of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
The XLogP value of 4.7818 indicates that tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.49 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate. Following Lipinski's Rule of Five, tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate has 1 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 tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The CAS number of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 840456-47-5.
What is the molecular formula of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular formula of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is C23H23ClN4O4.
What is the molecular weight of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular weight of tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 454.14 g/mol.
Where can I buy tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
You can request a quote for tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-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 tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl 2-amino-1-(5-chloro-2,4-dimethoxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.