![[Diphenyl(pyridin-4-yl)methyl] acetate structure](/static/products/5481/54813-57-9.webp)
[Diphenyl(pyridin-4-yl)methyl] acetate
TL;DR: [Diphenyl(pyridin-4-yl)methyl] acetate (CAS 54813-57-9) is a chemical compound with molecular formula C20H17NO2 and molecular weight 303.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[diphenyl(pyridin-4-yl)methyl] acetate
Also Known As: [diphenyl(pyridin-4-yl)methyl] acetate|Diphenyl(pyridin-4-yl)methyl acetate
| Molecular Formula | C20H17NO2 |
|---|---|
| Molecular Weight | 303.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.12592 |
| Heavy Atoms | 23 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 54813-57-9 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=NC=C3 |
| InChIKey | XHYDJHBZUNKCCP-UHFFFAOYSA-N |
Product Overview
[Diphenyl(pyridin-4-yl)methyl] acetate (CAS 54813-57-9), with molecular formula C20H17NO2 and molecular weight 303.13 g/mol. IUPAC: [diphenyl(pyridin-4-yl)methyl] acetate.
Chemical Property Profile of [Diphenyl(pyridin-4-yl)methyl] acetate
Property Insights of [Diphenyl(pyridin-4-yl)methyl] acetate
The XLogP value of 3.7 indicates that [Diphenyl(pyridin-4-yl)methyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.2 Ų, [Diphenyl(pyridin-4-yl)methyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [Diphenyl(pyridin-4-yl)methyl] acetate has 0 hydrogen bond donor(s) and 3 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 [Diphenyl(pyridin-4-yl)methyl] acetate?
The CAS number of [Diphenyl(pyridin-4-yl)methyl] acetate is 54813-57-9.
What is the molecular formula of [Diphenyl(pyridin-4-yl)methyl] acetate?
The molecular formula of [Diphenyl(pyridin-4-yl)methyl] acetate is C20H17NO2.
What is the molecular weight of [Diphenyl(pyridin-4-yl)methyl] acetate?
The molecular weight of [Diphenyl(pyridin-4-yl)methyl] acetate is 303.13 g/mol.
Where can I buy [Diphenyl(pyridin-4-yl)methyl] acetate?
You can request a quote for [Diphenyl(pyridin-4-yl)methyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [Diphenyl(pyridin-4-yl)methyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [Diphenyl(pyridin-4-yl)methyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.