A2293/0096616
TL;DR: A2293/0096616 (CAS 330950-65-7) is a chemical compound with molecular formula C21H20F3N5O4 and molecular weight 463.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-4-phenyl-1,2,5-oxadiazole
Also Known As: A2293/0096616, 3-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-4-phenyl-1,2,5-oxadiazole, 1-[2-nitro-4-(trifluoromethyl)phenyl]-4-{2-[(4-phenyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}piperazine, 3-(2-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazinyl}ethoxy)-4-phenyl-1,2,5- oxadiazole
| Molecular Formula | C21H20F3N5O4 |
|---|---|
| Molecular Weight | 463.15 g/mol |
| LogP | 3.8646 |
| Topological Polar Surface Area | 97.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.14673 |
| Heavy Atoms | 33 |
| Complexity | 1098.7797 |
Chemical Identifiers
| CAS Number | 330950-65-7 |
|---|---|
| SMILES | C1CN(CCN1CCOC2=NON=C2C3=CC=CC=C3)C4=C(C=C(C=C4)C(F)(F)F)[N+](=O)[O-] |
Product Overview
A2293/0096616 (CAS 330950-65-7), with molecular formula C21H20F3N5O4 and molecular weight 463.15 g/mol. IUPAC: 3-[2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]-4-phenyl-1,2,5-oxadiazole.
Chemical Property Profile of A2293/0096616
Property Insights of A2293/0096616
The XLogP value of 3.8646 indicates that A2293/0096616 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.77 Ų falls within the moderate polarity range, balancing permeability and solubility for A2293/0096616. Following Lipinski's Rule of Five, A2293/0096616 has 0 hydrogen bond donor(s) and 8 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 A2293/0096616?
The CAS number of A2293/0096616 is 330950-65-7.
What is the molecular formula of A2293/0096616?
The molecular formula of A2293/0096616 is C21H20F3N5O4.
What is the molecular weight of A2293/0096616?
The molecular weight of A2293/0096616 is 463.15 g/mol.
Where can I buy A2293/0096616?
You can request a quote for A2293/0096616 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2293/0096616?
Yes, KEHONG BIO provides custom synthesis services for A2293/0096616 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.