Naphthalen-1-yl 3,4,5-trimethoxybenzoate
TL;DR: Naphthalen-1-yl 3,4,5-trimethoxybenzoate (CAS 457923-29-4) is a chemical compound with molecular formula C20H18O5 and molecular weight 338.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-1-yl 3,4,5-trimethoxybenzoate
Also Known As: 1-naphthyl 3,4,5-trimethoxybenzoate, naphthalen-1-yl 3,4,5-trimethoxybenzoate, 1-Naphthalenyl 3,4,5-trimethoxybenzoate, naphthyl 3,4,5-trimethoxybenzoate, AN-652/11812325
| Molecular Formula | C20H18O5 |
|---|---|
| Molecular Weight | 338.12 g/mol |
| LogP | 4.0848 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 338.11542 |
| Heavy Atoms | 25 |
| Complexity | 886.60364 |
Chemical Identifiers
| CAS Number | 457923-29-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC=CC3=CC=CC=C32 |
Product Overview
Naphthalen-1-yl 3,4,5-trimethoxybenzoate (CAS 457923-29-4), with molecular formula C20H18O5 and molecular weight 338.12 g/mol. IUPAC: naphthalen-1-yl 3,4,5-trimethoxybenzoate.
Chemical Property Profile of Naphthalen-1-yl 3,4,5-trimethoxybenzoate
Property Insights of Naphthalen-1-yl 3,4,5-trimethoxybenzoate
The XLogP value of 4.0848 indicates that Naphthalen-1-yl 3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.99 Ų, Naphthalen-1-yl 3,4,5-trimethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalen-1-yl 3,4,5-trimethoxybenzoate 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 Naphthalen-1-yl 3,4,5-trimethoxybenzoate?
The CAS number of Naphthalen-1-yl 3,4,5-trimethoxybenzoate is 457923-29-4.
What is the molecular formula of Naphthalen-1-yl 3,4,5-trimethoxybenzoate?
The molecular formula of Naphthalen-1-yl 3,4,5-trimethoxybenzoate is C20H18O5.
What is the molecular weight of Naphthalen-1-yl 3,4,5-trimethoxybenzoate?
The molecular weight of Naphthalen-1-yl 3,4,5-trimethoxybenzoate is 338.12 g/mol.
Where can I buy Naphthalen-1-yl 3,4,5-trimethoxybenzoate?
You can request a quote for Naphthalen-1-yl 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalen-1-yl 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Naphthalen-1-yl 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.