5L-048
TL;DR: 5L-048 (CAS 478048-52-1) is a chemical compound with molecular formula C16H15Cl2F3N4 and molecular weight 390.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(6-chloro-3-pyridinyl)methyl]-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine
Also Known As: 5L-048, 1-[(6-chloro-3-pyridinyl)methyl]-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine, 1-[(6-chloropyridin-3-yl)methyl]-4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazine, 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-[(6-chloropyridin-3-yl)methyl]piperazine
| Molecular Formula | C16H15Cl2F3N4 |
|---|---|
| Molecular Weight | 390.06 g/mol |
| LogP | 4.1244 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 390.0626 |
| Heavy Atoms | 25 |
| Complexity | 729.14996 |
Chemical Identifiers
| CAS Number | 478048-52-1 |
|---|---|
| SMILES | C1CN(CCN1CC2=CN=C(C=C2)Cl)C3=C(C=C(C=N3)C(F)(F)F)Cl |
Product Overview
5L-048 (CAS 478048-52-1), with molecular formula C16H15Cl2F3N4 and molecular weight 390.06 g/mol. IUPAC: 1-[(6-chloro-3-pyridinyl)methyl]-4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine.
Chemical Property Profile of 5L-048
Property Insights of 5L-048
The XLogP value of 4.1244 indicates that 5L-048 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.26 Ų, 5L-048 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5L-048 has 0 hydrogen bond donor(s) and 4 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 5L-048?
The CAS number of 5L-048 is 478048-52-1.
What is the molecular formula of 5L-048?
The molecular formula of 5L-048 is C16H15Cl2F3N4.
What is the molecular weight of 5L-048?
The molecular weight of 5L-048 is 390.06 g/mol.
Where can I buy 5L-048?
You can request a quote for 5L-048 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5L-048?
Yes, KEHONG BIO provides custom synthesis services for 5L-048 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.