CGS12066B
TL;DR: CGS12066B (CAS 109028-09-3) is a chemical compound with molecular formula C17H17F3N4 and molecular weight 334.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
CGS12066B
4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
Also Known As: CGS 12066B-parent, c-JUN peptide, 4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline, Cgs 12066, CGS 12066B
| Molecular Formula | C17H17F3N4 |
|---|---|
| Molecular Weight | 334.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.14053 |
| Heavy Atoms | 24 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 109028-09-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=C(C=CC(=C3)C(F)(F)F)N4C2=CC=C4 |
| InChIKey | LXFHSCDLMBZYKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CGS12066B (CAS 109028-09-3), with molecular formula C17H17F3N4 and molecular weight 334.14 g/mol. IUPAC: 4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline.
Chemical Property Profile of CGS12066B
Property Insights of CGS12066B
The XLogP value of 4.0 indicates that CGS12066B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, CGS12066B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CGS12066B has 0 hydrogen bond donor(s) and 6 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 CGS12066B?
The CAS number of CGS12066B is 109028-09-3.
What is the molecular formula of CGS12066B?
The molecular formula of CGS12066B is C17H17F3N4.
What is the molecular weight of CGS12066B?
The molecular weight of CGS12066B is 334.14 g/mol.
Where can I buy CGS12066B?
You can request a quote for CGS12066B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CGS12066B?
Yes, KEHONG BIO provides custom synthesis services for CGS12066B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.