4-Pyridinecarboxylic acid, diphenylmethyl ester
TL;DR: 4-Pyridinecarboxylic acid, diphenylmethyl ester (CAS 112981-39-2) is a chemical compound with molecular formula C19H15NO2 and molecular weight 289.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzhydryl pyridine-4-carboxylate
Also Known As: Benzhydryl isonicotinate, diphenylmethyl isonicotinate, benzhydryl pyridine-4-carboxylate, 4-Pyridinecarboxylic acid, diphenylmethyl ester, diphenylmethyl pyridine-4-carboxylate
| Molecular Formula | C19H15NO2 |
|---|---|
| Molecular Weight | 289.11 g/mol |
| LogP | 4.028 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.1103 |
| Heavy Atoms | 22 |
| Complexity | 687.6567 |
Chemical Identifiers
| CAS Number | 112981-39-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)C3=CC=NC=C3 |
Product Overview
4-Pyridinecarboxylic acid, diphenylmethyl ester (CAS 112981-39-2), with molecular formula C19H15NO2 and molecular weight 289.11 g/mol. IUPAC: benzhydryl pyridine-4-carboxylate.
Chemical Property Profile of 4-Pyridinecarboxylic acid, diphenylmethyl ester
Property Insights of 4-Pyridinecarboxylic acid, diphenylmethyl ester
The XLogP value of 4.028 indicates that 4-Pyridinecarboxylic acid, diphenylmethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.19 Ų, 4-Pyridinecarboxylic acid, diphenylmethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Pyridinecarboxylic acid, diphenylmethyl ester 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 4-Pyridinecarboxylic acid, diphenylmethyl ester?
The CAS number of 4-Pyridinecarboxylic acid, diphenylmethyl ester is 112981-39-2.
What is the molecular formula of 4-Pyridinecarboxylic acid, diphenylmethyl ester?
The molecular formula of 4-Pyridinecarboxylic acid, diphenylmethyl ester is C19H15NO2.
What is the molecular weight of 4-Pyridinecarboxylic acid, diphenylmethyl ester?
The molecular weight of 4-Pyridinecarboxylic acid, diphenylmethyl ester is 289.11 g/mol.
Where can I buy 4-Pyridinecarboxylic acid, diphenylmethyl ester?
You can request a quote for 4-Pyridinecarboxylic acid, diphenylmethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridinecarboxylic acid, diphenylmethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridinecarboxylic acid, diphenylmethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.