RefChem:825898
TL;DR: RefChem:825898 (CAS 556802-21-2) is a chemical compound with molecular formula C18H14F6N4OS2 and molecular weight 480.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
Also Known As: N-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-2-{[4-ETHYL-5-(2-THIENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL}ACETAMIDE, N-(3,5-Bis(trifluoromethyl)phenyl)-2-((4-ethyl-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide, 649-527-3, N-(3,5-Bis(trifluoromethyl)phenyl)-2-((4-ethyl-5-(2-thienyl)-4H-1,2,4-triazol-3-YL)sulfanyl)acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-ethyl-5-(2-thienyl)(1,2,4-triazol-3-yl thio))acetamide
| Molecular Formula | C18H14F6N4OS2 |
|---|---|
| Molecular Weight | 480.05 g/mol |
| LogP | 5.7949 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.05133 |
| Heavy Atoms | 31 |
| Complexity | 1027.9272 |
Chemical Identifiers
| CAS Number | 556802-21-2 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CS3 |
Product Overview
RefChem:825898 (CAS 556802-21-2), with molecular formula C18H14F6N4OS2 and molecular weight 480.05 g/mol. IUPAC: N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide.
Chemical Property Profile of RefChem:825898
Property Insights of RefChem:825898
The XLogP value of 5.7949 indicates that RefChem:825898 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, RefChem:825898 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:825898 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:825898?
The CAS number of RefChem:825898 is 556802-21-2.
What is the molecular formula of RefChem:825898?
The molecular formula of RefChem:825898 is C18H14F6N4OS2.
What is the molecular weight of RefChem:825898?
The molecular weight of RefChem:825898 is 480.05 g/mol.
Where can I buy RefChem:825898?
You can request a quote for RefChem:825898 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:825898?
Yes, KEHONG BIO provides custom synthesis services for RefChem:825898 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.