吡非尼酮
TL;DR: 吡非尼酮 (CAS 53179-13-8) is a chemical compound with molecular formula C12H11NO and molecular weight 185.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡非尼酮
5-methyl-1-phenylpyridin-2-one
Also Known As: PIRFENIDONE, Esbriet, Pirespa, Pirfenidona, Pirfenidonum
| Molecular Formula | C12H11NO |
|---|---|
| Molecular Weight | 185.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.08406 |
| Heavy Atoms | 14 |
| Complexity | 285.0 |
| Melting Point | 109 |
| Solubility | Solubule in methanol |
Chemical Identifiers
| CAS Number | 53179-13-8 |
|---|---|
| SMILES | CC1=CN(C(=O)C=C1)C2=CC=CC=C2 |
| InChIKey | ISWRGOKTTBVCFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡非尼酮 (CAS 53179-13-8), with molecular formula C12H11NO and molecular weight 185.08 g/mol. IUPAC: 5-methyl-1-phenylpyridin-2-one.
Chemical Property Profile of 吡非尼酮
Property Insights of 吡非尼酮
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吡非尼酮. With a topological polar surface area (TPSA) of 20.3 Ų, 吡非尼酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 吡非尼酮 has 0 hydrogen bond donor(s) and 1 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 吡非尼酮?
The CAS number of 吡非尼酮 is 53179-13-8.
What is the molecular formula of 吡非尼酮?
The molecular formula of 吡非尼酮 is C12H11NO.
What is the molecular weight of 吡非尼酮?
The molecular weight of 吡非尼酮 is 185.08 g/mol.
Where can I buy 吡非尼酮?
You can request a quote for 吡非尼酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡非尼酮?
Yes, KEHONG BIO provides custom synthesis services for 吡非尼酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.