Ethanone, 1,1'-(3,5-pyridinediyl)bis-
TL;DR: Ethanone, 1,1'-(3,5-pyridinediyl)bis- (CAS 14133-90-5) is a chemical compound with molecular formula C9H9NO2 and molecular weight 163.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetyl-3-pyridinyl)ethanone
Also Known As: 3,5-Diacetylpyridine, Pyridine, 3,5-diacetyl-, 1-(5-acetylpyridin-3-yl)ethanone, 3,5-Diacetyl-pyridin, Ethanone, 1,1'-(3,5-pyridinediyl)bis-
| Molecular Formula | C9H9NO2 |
|---|---|
| Molecular Weight | 163.06 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 47.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.06332 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 14133-90-5 |
|---|---|
| SMILES | CC(=O)C1=CC(=CN=C1)C(=O)C |
| InChIKey | RLWNMLQDGSJZEL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1,1'-(3,5-pyridinediyl)bis- (CAS 14133-90-5), with molecular formula C9H9NO2 and molecular weight 163.06 g/mol. IUPAC: 1-(5-acetyl-3-pyridinyl)ethanone.
Chemical Property Profile of Ethanone, 1,1'-(3,5-pyridinediyl)bis-
Property Insights of Ethanone, 1,1'-(3,5-pyridinediyl)bis-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1,1'-(3,5-pyridinediyl)bis-. With a topological polar surface area (TPSA) of 47.0 Ų, Ethanone, 1,1'-(3,5-pyridinediyl)bis- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1,1'-(3,5-pyridinediyl)bis- 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 Ethanone, 1,1'-(3,5-pyridinediyl)bis-?
The CAS number of Ethanone, 1,1'-(3,5-pyridinediyl)bis- is 14133-90-5.
What is the molecular formula of Ethanone, 1,1'-(3,5-pyridinediyl)bis-?
The molecular formula of Ethanone, 1,1'-(3,5-pyridinediyl)bis- is C9H9NO2.
What is the molecular weight of Ethanone, 1,1'-(3,5-pyridinediyl)bis-?
The molecular weight of Ethanone, 1,1'-(3,5-pyridinediyl)bis- is 163.06 g/mol.
Where can I buy Ethanone, 1,1'-(3,5-pyridinediyl)bis-?
You can request a quote for Ethanone, 1,1'-(3,5-pyridinediyl)bis- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1,1'-(3,5-pyridinediyl)bis-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1,1'-(3,5-pyridinediyl)bis- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.