11W-0857
TL;DR: 11W-0857 (CAS 860784-12-9) is a chemical compound with molecular formula C21H19F3N2O3S and molecular weight 436.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(trifluoromethyl)anilino]acetate
Also Known As: 11W-0857, ethyl 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(trifluoromethyl)anilino]acetate, ethyl 2-[N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(trifluoromethyl)anilino]acetate, ethyl 2-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl][4-(trifluoromethyl)phenyl]amino}acetate, Ethyl 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-[4-(trifluoromethyl)phenyl]amino]acetate
| Molecular Formula | C21H19F3N2O3S |
|---|---|
| Molecular Weight | 436.11 g/mol |
| LogP | 5.5387 |
| Topological Polar Surface Area | 51.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 436.10684 |
| Heavy Atoms | 30 |
| Complexity | 985.9812 |
Chemical Identifiers
| CAS Number | 860784-12-9 |
|---|---|
| SMILES | CCOC(=O)CN(C1=CC=C(C=C1)C(F)(F)F)C2=NC(=CS2)C3=CC=C(C=C3)OC |
Product Overview
11W-0857 (CAS 860784-12-9), with molecular formula C21H19F3N2O3S and molecular weight 436.11 g/mol. IUPAC: ethyl 2-[N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-4-(trifluoromethyl)anilino]acetate.
Chemical Property Profile of 11W-0857
Property Insights of 11W-0857
The XLogP value of 5.5387 indicates that 11W-0857 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.66 Ų, 11W-0857 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11W-0857 has 0 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 11W-0857?
The CAS number of 11W-0857 is 860784-12-9.
What is the molecular formula of 11W-0857?
The molecular formula of 11W-0857 is C21H19F3N2O3S.
What is the molecular weight of 11W-0857?
The molecular weight of 11W-0857 is 436.11 g/mol.
Where can I buy 11W-0857?
You can request a quote for 11W-0857 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11W-0857?
Yes, KEHONG BIO provides custom synthesis services for 11W-0857 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.