TL;DR: CGS 12066B-parent (CAS 109028-09-3) is a chemical compound with molecular formula C17H17F3N4 and molecular weight 334.14053 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
c-JUN peptide
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
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H17F3N4 |
| Molecular Weight | 334.14053 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.14053 Da |
| Heavy Atoms | 24 |
| Complexity | 450.0 |
| SMILES | CN1CCN(CC1)C2=NC3=C(C=CC(=C3)C(F)(F)F)N4C2=CC=C4 |
| InChIKey | LXFHSCDLMBZYKY-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that CGS 12066B-parent is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, CGS 12066B-parent exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CGS 12066B-parent has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CGS 12066B-parent is 109028-09-3.
The molecular formula of CGS 12066B-parent is C17H17F3N4.
The molecular weight of CGS 12066B-parent is 334.14053 g/mol.
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