AB00116642-01
TL;DR: AB00116642-01 (CAS 371947-46-5) is a chemical compound with molecular formula C23H24N4O4 and molecular weight 420.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate
Also Known As: AB00116642-01, ethyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, ethyl 2-amino-1-(3,4-dimethoxyphenethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate, ethyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate
| Molecular Formula | C23H24N4O4 |
|---|---|
| Molecular Weight | 420.18 g/mol |
| LogP | 3.6033 |
| Topological Polar Surface Area | 101.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.17975 |
| Heavy Atoms | 31 |
| Complexity | 1265.6399 |
Chemical Identifiers
| CAS Number | 371947-46-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC4=CC(=C(C=C4)OC)OC)N |
Product Overview
AB00116642-01 (CAS 371947-46-5), with molecular formula C23H24N4O4 and molecular weight 420.18 g/mol. IUPAC: ethyl 2-amino-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate.
Chemical Property Profile of AB00116642-01
Property Insights of AB00116642-01
The XLogP value of 3.6033 indicates that AB00116642-01 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 AB00116642-01. Following Lipinski's Rule of Five, AB00116642-01 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 AB00116642-01?
The CAS number of AB00116642-01 is 371947-46-5.
What is the molecular formula of AB00116642-01?
The molecular formula of AB00116642-01 is C23H24N4O4.
What is the molecular weight of AB00116642-01?
The molecular weight of AB00116642-01 is 420.18 g/mol.
Where can I buy AB00116642-01?
You can request a quote for AB00116642-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00116642-01?
Yes, KEHONG BIO provides custom synthesis services for AB00116642-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.