Ethanedione, di-3-pyridinyl-
TL;DR: Ethanedione, di-3-pyridinyl- (CAS 40505-30-4) 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-3-ylethane-1,2-dione
Also Known As: Ethanedione, di-3-pyridinyl-, 3,3'-Pyridil, Ethanedione,di-3-pyridinyl, 1,2-dipyridin-3-ylethane-1,2-dione, 1,2-di(pyridin-3-yl)ethane-1,2-dione
| Molecular Formula | C12H8N2O2 |
|---|---|
| Molecular Weight | 212.06 g/mol |
| LogP | 0.8 |
| 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 | 40505-30-4 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)C(=O)C2=CN=CC=C2 |
| InChIKey | WKQMLIVNOYGANQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanedione, di-3-pyridinyl- (CAS 40505-30-4), with molecular formula C12H8N2O2 and molecular weight 212.06 g/mol. IUPAC: 1,2-dipyridin-3-ylethane-1,2-dione.
Chemical Property Profile of Ethanedione, di-3-pyridinyl-
Property Insights of Ethanedione, di-3-pyridinyl-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanedione, di-3-pyridinyl-. With a topological polar surface area (TPSA) of 59.9 Ų, Ethanedione, di-3-pyridinyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanedione, di-3-pyridinyl- 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 Ethanedione, di-3-pyridinyl-?
The CAS number of Ethanedione, di-3-pyridinyl- is 40505-30-4.
What is the molecular formula of Ethanedione, di-3-pyridinyl-?
The molecular formula of Ethanedione, di-3-pyridinyl- is C12H8N2O2.
What is the molecular weight of Ethanedione, di-3-pyridinyl-?
The molecular weight of Ethanedione, di-3-pyridinyl- is 212.06 g/mol.
Where can I buy Ethanedione, di-3-pyridinyl-?
You can request a quote for Ethanedione, di-3-pyridinyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanedione, di-3-pyridinyl-?
Yes, KEHONG BIO provides custom synthesis services for Ethanedione, di-3-pyridinyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.