Isoficine
TL;DR: Isoficine (CAS 2255-62-1) is a chemical compound with molecular formula C20H19NO4 and molecular weight 337.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-6-(1-methylpyrrolidin-2-yl)-2-phenylchromen-4-one
Also Known As: Isoficine, iso-Ficine, 5,7-dihydroxy-6-(1-methylpyrrolidin-2-yl)-2-phenylchromen-4-one, 4H-1-Benzopyran-4-one, 5,7-dihydroxy-6-(1-methyl-2-pyrrolidinyl)-2-phenyl-, 5,7-Dihydroxy-6-(1-methyl-2-pyrrolidinyl)flavone
| Molecular Formula | C20H19NO4 |
|---|---|
| Molecular Weight | 337.13 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 70.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.1314 |
| Heavy Atoms | 25 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 2255-62-1 |
|---|---|
| SMILES | CN1CCCC1C2=C(C3=C(C=C2O)OC(=CC3=O)C4=CC=CC=C4)O |
| InChIKey | OTHGANFGYSWHJH-UHFFFAOYSA-N |
Product Overview
Isoficine (CAS 2255-62-1), with molecular formula C20H19NO4 and molecular weight 337.13 g/mol. IUPAC: 5,7-dihydroxy-6-(1-methylpyrrolidin-2-yl)-2-phenylchromen-4-one.
Chemical Property Profile of Isoficine
Property Insights of Isoficine
The XLogP value of 3.4 indicates that Isoficine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoficine. Following Lipinski's Rule of Five, Isoficine has 2 hydrogen bond donor(s) and 5 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 Isoficine?
The CAS number of Isoficine is 2255-62-1.
What is the molecular formula of Isoficine?
The molecular formula of Isoficine is C20H19NO4.
What is the molecular weight of Isoficine?
The molecular weight of Isoficine is 337.13 g/mol.
Where can I buy Isoficine?
You can request a quote for Isoficine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoficine?
Yes, KEHONG BIO provides custom synthesis services for Isoficine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.