RefChem:1097593
TL;DR: RefChem:1097593 (CAS 2920-52-7) is a chemical compound with molecular formula C24H26F3NO5 and molecular weight 465.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;1-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine
Also Known As: 1-(2-(alpha-(alpha,alpha,alpha-Trifluoro-o-tolyl)benzyloxy)ethyl)pyrrolidine fumarate, Pyrrolidine, 1-(2-(alpha-(alpha,alpha,alpha-trifluoro-o-tolyl)benzyloxy)ethyl)-, fumarate, (E)-but-2-enedioic acid; 1-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine, Pyrrolidine, 1-[2-[phenyl[2-(trifluoromethyl)phenyl]methoxy]ethyl]-, (E)-2-butenedioate (1:1), RefChem:1097593
| Molecular Formula | C24H26F3NO5 |
|---|---|
| Molecular Weight | 465.18 g/mol |
| LogP | 4.619 |
| Topological Polar Surface Area | 87.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 465.1763 |
| Heavy Atoms | 33 |
| Complexity | 909.19696 |
Chemical Identifiers
| CAS Number | 2920-52-7 |
|---|---|
| SMILES | C1CCN(C1)CCOC(C2=CC=CC=C2)C3=CC=CC=C3C(F)(F)F.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1097593 (CAS 2920-52-7), with molecular formula C24H26F3NO5 and molecular weight 465.18 g/mol. IUPAC: (E)-but-2-enedioic acid;1-[2-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]ethyl]pyrrolidine.
Chemical Property Profile of RefChem:1097593
Property Insights of RefChem:1097593
The XLogP value of 4.619 indicates that RefChem:1097593 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.07 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1097593. Following Lipinski's Rule of Five, RefChem:1097593 has 2 hydrogen bond donor(s) and 4 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 RefChem:1097593?
The CAS number of RefChem:1097593 is 2920-52-7.
What is the molecular formula of RefChem:1097593?
The molecular formula of RefChem:1097593 is C24H26F3NO5.
What is the molecular weight of RefChem:1097593?
The molecular weight of RefChem:1097593 is 465.18 g/mol.
Where can I buy RefChem:1097593?
You can request a quote for RefChem:1097593 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1097593?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1097593 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.