propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
TL;DR: propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 848739-88-8) is a chemical compound with molecular formula C18H22N4O2 and molecular weight 326.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2-amino-1-butylpyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, propyl 2-amino-1-butylpyrrolo[3,2-b]quinoxaline-3-carboxylate
| Molecular Formula | C18H22N4O2 |
|---|---|
| Molecular Weight | 326.17 g/mol |
| LogP | 3.5336 |
| Topological Polar Surface Area | 83.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.1743 |
| Heavy Atoms | 24 |
| Complexity | 885.4828 |
Chemical Identifiers
| CAS Number | 848739-88-8 |
|---|---|
| SMILES | CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCCC)N |
Product Overview
propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate (CAS 848739-88-8), with molecular formula C18H22N4O2 and molecular weight 326.17 g/mol. IUPAC: propyl 2-amino-1-butylpyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Property Insights of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
The XLogP value of 3.5336 indicates that propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.03 Ų falls within the moderate polarity range, balancing permeability and solubility for propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate. Following Lipinski's Rule of Five, propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate has 1 hydrogen bond donor(s) and 5 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 propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The CAS number of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 848739-88-8.
What is the molecular formula of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular formula of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is C18H22N4O2.
What is the molecular weight of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
The molecular weight of propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate is 326.17 g/mol.
Where can I buy propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
You can request a quote for propyl 2-amino-1-butyl-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 propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for propyl 2-amino-1-butyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.