![butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate structure](/static/products/577/577787-64-5.png)
butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate
TL;DR: butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate (CAS 577787-64-5) is a chemical compound with molecular formula C27H31N5O4 and molecular weight 489.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 4-[2-amino-3-(3-ethoxypropylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]benzoate
Also Known As: butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate, butyl 4-[2-amino-3-(3-ethoxypropylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]benzoate, butyl 4-{2-amino-3-[(3-ethoxypropyl)carbamoyl]-1H-pyrrolo[2,3-b]quinoxalin-1-yl}benzoate
| Molecular Formula | C27H31N5O4 |
|---|---|
| Molecular Weight | 489.24 g/mol |
| LogP | 4.2692 |
| Topological Polar Surface Area | 121.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 489.2376 |
| Heavy Atoms | 36 |
| Complexity | 1364.3649 |
Chemical Identifiers
| CAS Number | 577787-64-5 |
|---|---|
| SMILES | CCCCOC(=O)C1=CC=C(C=C1)N2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCCCOCC)N |
Product Overview
butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate (CAS 577787-64-5), with molecular formula C27H31N5O4 and molecular weight 489.24 g/mol. IUPAC: butyl 4-[2-amino-3-(3-ethoxypropylcarbamoyl)pyrrolo[3,2-b]quinoxalin-1-yl]benzoate.
Chemical Property Profile of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate
Property Insights of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate
The XLogP value of 4.2692 indicates that butyl 4-(2-amino-3-((3-ethoxypropyl)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 121.36 Ų falls within the moderate polarity range, balancing permeability and solubility for butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate. Following Lipinski's Rule of Five, butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)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 butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
The CAS number of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is 577787-64-5.
What is the molecular formula of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
The molecular formula of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is C27H31N5O4.
What is the molecular weight of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
The molecular weight of butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate is 489.24 g/mol.
Where can I buy butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
You can request a quote for butyl 4-(2-amino-3-((3-ethoxypropyl)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 butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for butyl 4-(2-amino-3-((3-ethoxypropyl)carbamoyl)-1H-pyrrolo[2,3-b]quinoxalin-1-yl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.