![isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate structure](/static/products/799/799836-80-9.png)
isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
TL;DR: isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 799836-80-9) is a chemical compound with molecular formula C27H32N4O4 and molecular weight 476.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl 2-amino-1-[2-(3,4-diethoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, 2-methylpropyl 2-amino-1-[2-(3,4-diethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, 2-methylpropyl 2-amino-1-[2-(3,4-diethoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate
| Molecular Formula | C27H32N4O4 |
|---|---|
| Molecular Weight | 476.24 g/mol |
| LogP | 5.0196 |
| Topological Polar Surface Area | 101.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 476.24237 |
| Heavy Atoms | 35 |
| Complexity | 1346.2701 |
Chemical Identifiers
| CAS Number | 799836-80-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CCN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)OCC(C)C)N)OCC |
Product Overview
isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 799836-80-9), with molecular formula C27H32N4O4 and molecular weight 476.24 g/mol. IUPAC: 2-methylpropyl 2-amino-1-[2-(3,4-diethoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Property Insights of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
The XLogP value of 5.0196 indicates that isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-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 isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate. Following Lipinski's Rule of Five, isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The CAS number of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 799836-80-9.
What is the molecular formula of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular formula of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is C27H32N4O4.
What is the molecular weight of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular weight of isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 476.24 g/mol.
Where can I buy isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
You can request a quote for isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-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 isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for isobutyl 2-amino-1-(3,4-diethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.