2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride
TL;DR: 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride (CAS 42023-79-0) is a chemical compound with molecular formula C22H22ClNO3 and molecular weight 383.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridin-2-ylmethyl 2-ethoxy-2,2-diphenylacetate;hydrochloride
Also Known As: 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride, Benzeneacetic acid, alpha-ethoxy-alpha-phenyl-, 2-pyridinylmethyl ester, hydrochloride, pyridin-2-ylmethyl 2-ethoxy-2,2-diphenylacetate hydrochloride, (Pyridin-2-yl)methyl ethoxydi(phenyl)acetate--hydrogen chloride (1/1), RefChem:324267
| Molecular Formula | C22H22ClNO3 |
|---|---|
| Molecular Weight | 383.13 g/mol |
| LogP | 4.5269 |
| Topological Polar Surface Area | 48.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 383.1288 |
| Heavy Atoms | 27 |
| Complexity | 786.45123 |
Chemical Identifiers
| CAS Number | 42023-79-0 |
|---|---|
| SMILES | CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCC3=CC=CC=N3.Cl |
Product Overview
2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride (CAS 42023-79-0), with molecular formula C22H22ClNO3 and molecular weight 383.13 g/mol. IUPAC: pyridin-2-ylmethyl 2-ethoxy-2,2-diphenylacetate;hydrochloride.
Chemical Property Profile of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride
Property Insights of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride
The XLogP value of 4.5269 indicates that 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.42 Ų, 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride 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 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride?
The CAS number of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride is 42023-79-0.
What is the molecular formula of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride?
The molecular formula of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride is C22H22ClNO3.
What is the molecular weight of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride?
The molecular weight of 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride is 383.13 g/mol.
Where can I buy 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride?
You can request a quote for 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyridinylmethyl 2,2-diphenyl-2-ethoxyacetate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.