nchembio804-comp3
TL;DR: nchembio804-comp3 (CAS 256414-75-2) is a chemical compound with molecular formula C20H10F6N2OS and molecular weight 440.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole
Also Known As: nchembio804-comp3, L-LUCIFERIN, 5-[4-Phenyl-5-(trifluoromethyl)-2-thienyl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole, S1P1 Receptor Agonist, SEW2871, 5-(4-Phenyl-5-(trifluoromethyl)thiophen-2-yl)-3-(3-(trifluoromethyl)phenyl)-1,2,4-oxadiazole
| Molecular Formula | C20H10F6N2OS |
|---|---|
| Molecular Weight | 440.04 g/mol |
| LogP | 7.1697 |
| Topological Polar Surface Area | 38.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 440.0418 |
| Heavy Atoms | 30 |
| Complexity | 1177.9775 |
Chemical Identifiers
| CAS Number | 256414-75-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(SC(=C2)C3=NC(=NO3)C4=CC(=CC=C4)C(F)(F)F)C(F)(F)F |
Product Overview
nchembio804-comp3 (CAS 256414-75-2), with molecular formula C20H10F6N2OS and molecular weight 440.04 g/mol. IUPAC: 5-[4-phenyl-5-(trifluoromethyl)thiophen-2-yl]-3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazole.
Chemical Property Profile of nchembio804-comp3
Property Insights of nchembio804-comp3
The XLogP value of 7.1697 indicates that nchembio804-comp3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.92 Ų, nchembio804-comp3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, nchembio804-comp3 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of nchembio804-comp3?
The CAS number of nchembio804-comp3 is 256414-75-2.
What is the molecular formula of nchembio804-comp3?
The molecular formula of nchembio804-comp3 is C20H10F6N2OS.
What is the molecular weight of nchembio804-comp3?
The molecular weight of nchembio804-comp3 is 440.04 g/mol.
Where can I buy nchembio804-comp3?
You can request a quote for nchembio804-comp3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for nchembio804-comp3?
Yes, KEHONG BIO provides custom synthesis services for nchembio804-comp3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.