LY-042826 free base
TL;DR: LY-042826 free base (CAS 790197-92-1) is a chemical compound with molecular formula C20H27NO and molecular weight 297.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(2-methylphenyl)-phenylmethoxy]ethyl]butan-1-amine
Also Known As: LY-042826 free base, J1.454.260D, 1-Butanamine, N-(2-((2-methylphenyl)phenylmethoxy)ethyl)-, N-[2-[(2-Methylbenzhydryl)oxy]ethyl]-1-butanamine, butyl({2-[(2-methylphenyl)(phenyl)methoxy]ethyl})amine
| Molecular Formula | C20H27NO |
|---|---|
| Molecular Weight | 297.21 g/mol |
| LogP | 4.49072 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 297.20926 |
| Heavy Atoms | 22 |
| Complexity | 538.4133 |
Chemical Identifiers
| CAS Number | 790197-92-1 |
|---|---|
| SMILES | CCCCNCCOC(C1=CC=CC=C1)C2=CC=CC=C2C |
Product Overview
LY-042826 free base (CAS 790197-92-1), with molecular formula C20H27NO and molecular weight 297.21 g/mol. IUPAC: N-[2-[(2-methylphenyl)-phenylmethoxy]ethyl]butan-1-amine.
Chemical Property Profile of LY-042826 free base
Property Insights of LY-042826 free base
The XLogP value of 4.49072 indicates that LY-042826 free base is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.26 Ų, LY-042826 free base exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, LY-042826 free base has 1 hydrogen bond donor(s) and 2 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 LY-042826 free base?
The CAS number of LY-042826 free base is 790197-92-1.
What is the molecular formula of LY-042826 free base?
The molecular formula of LY-042826 free base is C20H27NO.
What is the molecular weight of LY-042826 free base?
The molecular weight of LY-042826 free base is 297.21 g/mol.
Where can I buy LY-042826 free base?
You can request a quote for LY-042826 free base directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LY-042826 free base?
Yes, KEHONG BIO provides custom synthesis services for LY-042826 free base and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.