Pyridin-3-yl 2-iodobenzoate
TL;DR: Pyridin-3-yl 2-iodobenzoate (CAS 499134-34-8) is a chemical compound with molecular formula C12H8INO2 and molecular weight 324.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyridin-3-yl 2-iodobenzoate
Also Known As: pyridin-3-yl 2-iodobenzoate, 3-pyridinyl 2-iodobenzoate, AO-365/40892275
| Molecular Formula | C12H8INO2 |
|---|---|
| Molecular Weight | 324.96 g/mol |
| LogP | 2.9054 |
| Topological Polar Surface Area | 39.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.96 |
| Heavy Atoms | 16 |
| Complexity | 499.38177 |
Chemical Identifiers
| CAS Number | 499134-34-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)OC2=CN=CC=C2)I |
Product Overview
Pyridin-3-yl 2-iodobenzoate (CAS 499134-34-8), with molecular formula C12H8INO2 and molecular weight 324.96 g/mol. IUPAC: pyridin-3-yl 2-iodobenzoate.
Chemical Property Profile of Pyridin-3-yl 2-iodobenzoate
Property Insights of Pyridin-3-yl 2-iodobenzoate
The XLogP value of 2.9054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridin-3-yl 2-iodobenzoate. With a topological polar surface area (TPSA) of 39.19 Ų, Pyridin-3-yl 2-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridin-3-yl 2-iodobenzoate 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 Pyridin-3-yl 2-iodobenzoate?
The CAS number of Pyridin-3-yl 2-iodobenzoate is 499134-34-8.
What is the molecular formula of Pyridin-3-yl 2-iodobenzoate?
The molecular formula of Pyridin-3-yl 2-iodobenzoate is C12H8INO2.
What is the molecular weight of Pyridin-3-yl 2-iodobenzoate?
The molecular weight of Pyridin-3-yl 2-iodobenzoate is 324.96 g/mol.
Where can I buy Pyridin-3-yl 2-iodobenzoate?
You can request a quote for Pyridin-3-yl 2-iodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridin-3-yl 2-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Pyridin-3-yl 2-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.