F0529-0880
TL;DR: F0529-0880 (CAS 477212-80-9) is a chemical compound with molecular formula C20H17F3N4O2S2 and molecular weight 466.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Also Known As: F0529-0880, N-(5-((2-oxo-2-((2-(trifluoromethyl)phenyl)amino)ethyl)thio)-1,3,4-thiadiazol-2-yl)-3-phenylpropanamide, N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide, 3-PHENYL-N-{5-[({[2-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}METHYL)SULFANYL]-1,3,4-THIADIAZOL-2-YL}PROPANAMIDE, N-[(2Z)-5-[(2-oxo-2-{[2-(trifluoromethyl)phenyl]amino}ethyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-phenylpropanamide
| Molecular Formula | C20H17F3N4O2S2 |
|---|---|
| Molecular Weight | 466.07 g/mol |
| LogP | 4.859 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.0745 |
| Heavy Atoms | 31 |
| Complexity | 1042.1592 |
Chemical Identifiers
| CAS Number | 477212-80-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCC(=O)NC2=NN=C(S2)SCC(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
F0529-0880 (CAS 477212-80-9), with molecular formula C20H17F3N4O2S2 and molecular weight 466.07 g/mol. IUPAC: N-[5-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide.
Chemical Property Profile of F0529-0880
Property Insights of F0529-0880
The XLogP value of 4.859 indicates that F0529-0880 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.98 Ų falls within the moderate polarity range, balancing permeability and solubility for F0529-0880. Following Lipinski's Rule of Five, F0529-0880 has 2 hydrogen bond donor(s) and 6 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 F0529-0880?
The CAS number of F0529-0880 is 477212-80-9.
What is the molecular formula of F0529-0880?
The molecular formula of F0529-0880 is C20H17F3N4O2S2.
What is the molecular weight of F0529-0880?
The molecular weight of F0529-0880 is 466.07 g/mol.
Where can I buy F0529-0880?
You can request a quote for F0529-0880 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0529-0880?
Yes, KEHONG BIO provides custom synthesis services for F0529-0880 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.