Di-2-pyridylethanedione
TL;DR: Di-2-pyridylethanedione (CAS 492-73-9) is a chemical compound with molecular formula C12H8N2O2 and molecular weight 212.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dipyridin-2-ylethane-1,2-dione
Also Known As: 2,2'-Pyridil, Di-2-pyridylglyoxal, Bipicolinoyl, Di-2-pyridylethanedione, pyridil
| Molecular Formula | C12H8N2O2 |
|---|---|
| Molecular Weight | 212.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 59.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.05858 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 492-73-9 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(=O)C(=O)C2=CC=CC=N2 |
| InChIKey | PIINXYKJQGMIOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Di-2-pyridylethanedione (CAS 492-73-9), with molecular formula C12H8N2O2 and molecular weight 212.06 g/mol. IUPAC: 1,2-dipyridin-2-ylethane-1,2-dione.
Chemical Property Profile of Di-2-pyridylethanedione
Property Insights of Di-2-pyridylethanedione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Di-2-pyridylethanedione. With a topological polar surface area (TPSA) of 59.9 Ų, Di-2-pyridylethanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Di-2-pyridylethanedione 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 Di-2-pyridylethanedione?
The CAS number of Di-2-pyridylethanedione is 492-73-9.
What is the molecular formula of Di-2-pyridylethanedione?
The molecular formula of Di-2-pyridylethanedione is C12H8N2O2.
What is the molecular weight of Di-2-pyridylethanedione?
The molecular weight of Di-2-pyridylethanedione is 212.06 g/mol.
Where can I buy Di-2-pyridylethanedione?
You can request a quote for Di-2-pyridylethanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-2-pyridylethanedione?
Yes, KEHONG BIO provides custom synthesis services for Di-2-pyridylethanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.