F0037-4759
TL;DR: F0037-4759 (CAS 60072-40-4) is a chemical compound with molecular formula C18H13NO3 and molecular weight 291.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetylnaphthalen-1-yl) pyridine-3-carboxylate
Also Known As: 2-acetylnaphthalen-1-yl nicotinate, 2-acetyl-1-naphthyl nicotinate, 2-acetylnaphthalen-1-yl pyridine-3-carboxylate, (2-acetylnaphthalen-1-yl) pyridine-3-carboxylate, 3-Pyridinecarboxylic acid, 2-acetyl-1-naphthalenyl ester
| Molecular Formula | C18H13NO3 |
|---|---|
| Molecular Weight | 291.09 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 56.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.08954 |
| Heavy Atoms | 22 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 60072-40-4 |
|---|---|
| SMILES | CC(=O)C1=C(C2=CC=CC=C2C=C1)OC(=O)C3=CN=CC=C3 |
| InChIKey | VBMXOXRYYKJHJC-UHFFFAOYSA-N |
Product Overview
F0037-4759 (CAS 60072-40-4), with molecular formula C18H13NO3 and molecular weight 291.09 g/mol. IUPAC: (2-acetylnaphthalen-1-yl) pyridine-3-carboxylate.
Chemical Property Profile of F0037-4759
Property Insights of F0037-4759
The XLogP value of 3.2 indicates that F0037-4759 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.3 Ų, F0037-4759 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0037-4759 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 F0037-4759?
The CAS number of F0037-4759 is 60072-40-4.
What is the molecular formula of F0037-4759?
The molecular formula of F0037-4759 is C18H13NO3.
What is the molecular weight of F0037-4759?
The molecular weight of F0037-4759 is 291.09 g/mol.
Where can I buy F0037-4759?
You can request a quote for F0037-4759 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0037-4759?
Yes, KEHONG BIO provides custom synthesis services for F0037-4759 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.