CTK4B6627
TL;DR: CTK4B6627 (CAS 130292-76-1) is a chemical compound with molecular formula C32H27F3N4O6 and molecular weight 620.1883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;phenyl-[4-[4-[[7-(trifluoromethyl)quinolin-4-yl]amino]benzoyl]piperazin-1-yl]methanone
Also Known As: Piperazine, 1-benzoyl-4-[4-[[7-(trifluoromethyl)-4-quinolinyl]amino]benzoyl]-, (2Z)-2-butenedioate (1:1)
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C32H27F3N4O6 |
| Molecular Weight | 620.1883 g/mol |
| XLogP | 5.3072 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 620.1883 Da |
| Heavy Atoms | 45 |
| Complexity | 906.0 |
| SMILES | C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F.C(=CC(=O)O)C(=O)O |
| InChIKey | VSNJRZFFDMETOW-UHFFFAOYSA-N |
Chemical Property Profile of CTK4B6627
Property Insights of CTK4B6627
The XLogP value of 5.3072 indicates that CTK4B6627 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting CTK4B6627 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CTK4B6627 has 3 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of CTK4B6627?
The CAS number of CTK4B6627 is 130292-76-1.
What is the molecular formula of CTK4B6627?
The molecular formula of CTK4B6627 is C32H27F3N4O6.
What is the molecular weight of CTK4B6627?
The molecular weight of CTK4B6627 is 620.1883 g/mol.
Where can I buy CTK4B6627?
You can request a quote for CTK4B6627 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CTK4B6627?
Yes, CoreyChem provides custom synthesis services for CTK4B6627 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.