甲吡酮
TL;DR: 甲吡酮 (CAS 54-36-4) is a chemical compound with molecular formula C14H14N2O and molecular weight 226.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲吡酮
2-methyl-1,2-dipyridin-3-ylpropan-1-one
Also Known As: metyrapone, Metopirone, Methopyrapone, Metopiron, Methapyrapone
| Molecular Formula | C14H14N2O |
|---|---|
| Molecular Weight | 226.11 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 42.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.11061 |
| Heavy Atoms | 17 |
| Complexity | 275.0 |
| Melting Point | 50.5 |
| Solubility | Sparingly soluble |
Chemical Identifiers
| CAS Number | 54-36-4 |
|---|---|
| SMILES | CC(C)(C1=CN=CC=C1)C(=O)C2=CN=CC=C2 |
| InChIKey | FJLBFSROUSIWMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲吡酮 (CAS 54-36-4), with molecular formula C14H14N2O and molecular weight 226.11 g/mol. IUPAC: 2-methyl-1,2-dipyridin-3-ylpropan-1-one.
Chemical Property Profile of 甲吡酮
Property Insights of 甲吡酮
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲吡酮. With a topological polar surface area (TPSA) of 42.9 Ų, 甲吡酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 美替拉酮 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 美替拉酮?
The CAS number of 美替拉酮 is 54-36-4.
What is the molecular formula of 美替拉酮?
The molecular formula of 美替拉酮 is C14H14N2O.
What is the molecular weight of 美替拉酮?
The molecular weight of 美替拉酮 is 226.11 g/mol.
Where can I buy 美替拉酮?
You can request a quote for 美替拉酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 美替拉酮?
Yes, KEHONG BIO provides custom synthesis services for 美替拉酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.