3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one
TL;DR: 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one (CAS 86535-76-4) is a chemical compound with molecular formula C14H9NO and molecular weight 207.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-1-pyridin-3-ylprop-2-yn-1-one
Also Known As: 3-phenyl-1-pyridin-3-ylprop-2-yn-1-one, 3-Pyridinyl(phenylethynyl) ketone, (3-Pyridyl)(phenylethynyl) ketone, 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one, 3-phenyl-1-(3-pyridyl)-2-propyn-1-one
| Molecular Formula | C14H9NO |
|---|---|
| Molecular Weight | 207.07 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.06842 |
| Heavy Atoms | 16 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 86535-76-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC(=O)C2=CN=CC=C2 |
| InChIKey | RWSCAPDAIPEMLF-UHFFFAOYSA-N |
Product Overview
3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one (CAS 86535-76-4), with molecular formula C14H9NO and molecular weight 207.07 g/mol. IUPAC: 3-phenyl-1-pyridin-3-ylprop-2-yn-1-one.
Chemical Property Profile of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one
Property Insights of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one. With a topological polar surface area (TPSA) of 30.0 Ų, 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one has 0 hydrogen bond donor(s) and 2 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 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one?
The CAS number of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one is 86535-76-4.
What is the molecular formula of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one?
The molecular formula of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one is C14H9NO.
What is the molecular weight of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one?
The molecular weight of 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one is 207.07 g/mol.
Where can I buy 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one?
You can request a quote for 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-1-(pyridin-3-yl)prop-2-yn-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.