6G-029
TL;DR: 6G-029 (CAS 338791-68-7) is a chemical compound with molecular formula C17H12ClF6N5 and molecular weight 435.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-5-(trifluoromethyl)pyridine-2-carbonitrile
Also Known As: 6G-029, 3-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-5-(trifluoromethyl)-2-pyridinecarbonitrile, 3-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-5-(trifluoromethyl)pyridine-2-carbonitrile, 3-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}-5-(trifluoromethyl)pyridine-2-carbonitrile
| Molecular Formula | C17H12ClF6N5 |
|---|---|
| Molecular Weight | 435.07 g/mol |
| LogP | 4.36588 |
| Topological Polar Surface Area | 56.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 435.06854 |
| Heavy Atoms | 29 |
| Complexity | 944.7955 |
Chemical Identifiers
| CAS Number | 338791-68-7 |
|---|---|
| SMILES | C1CN(CCN1C2=C(N=CC(=C2)C(F)(F)F)C#N)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
6G-029 (CAS 338791-68-7), with molecular formula C17H12ClF6N5 and molecular weight 435.07 g/mol. IUPAC: 3-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-5-(trifluoromethyl)pyridine-2-carbonitrile.
Chemical Property Profile of 6G-029
Property Insights of 6G-029
The XLogP value of 4.36588 indicates that 6G-029 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.05 Ų, 6G-029 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6G-029 has 0 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 6G-029?
The CAS number of 6G-029 is 338791-68-7.
What is the molecular formula of 6G-029?
The molecular formula of 6G-029 is C17H12ClF6N5.
What is the molecular weight of 6G-029?
The molecular weight of 6G-029 is 435.07 g/mol.
Where can I buy 6G-029?
You can request a quote for 6G-029 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6G-029?
Yes, KEHONG BIO provides custom synthesis services for 6G-029 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.