Scopinast
TL;DR: Scopinast (CAS 145574-90-9) is a chemical compound with molecular formula C31H31F2NO5 and molecular weight 535.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]propoxy]-6-methoxychromen-2-one
Also Known As: Scopinast, Scopinast [INN], scopinastum, 7-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]propoxy]-6-methoxychromen-2-one, 7-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]pr
| Molecular Formula | C31H31F2NO5 |
|---|---|
| Molecular Weight | 535.22 g/mol |
| LogP | 5.4968 |
| Topological Polar Surface Area | 72.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 535.21704 |
| Heavy Atoms | 39 |
| Complexity | 1416.0923 |
Chemical Identifiers
| CAS Number | 145574-90-9 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C=CC(=O)O2)OCCCN3CCC(CC3)C(C4=CC=C(C=C4)F)(C5=CC=C(C=C5)F)O |
Product Overview
Scopinast (CAS 145574-90-9), with molecular formula C31H31F2NO5 and molecular weight 535.22 g/mol. IUPAC: 7-[3-[4-[bis(4-fluorophenyl)-hydroxymethyl]piperidin-1-yl]propoxy]-6-methoxychromen-2-one.
Chemical Property Profile of Scopinast
Property Insights of Scopinast
The XLogP value of 5.4968 indicates that Scopinast is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Scopinast. Following Lipinski's Rule of Five, Scopinast has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Scopinast?
The CAS number of Scopinast is 145574-90-9.
What is the molecular formula of Scopinast?
The molecular formula of Scopinast is C31H31F2NO5.
What is the molecular weight of Scopinast?
The molecular weight of Scopinast is 535.22 g/mol.
Where can I buy Scopinast?
You can request a quote for Scopinast directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Scopinast?
Yes, KEHONG BIO provides custom synthesis services for Scopinast and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.