K6FZY58H95
TL;DR: K6FZY58H95 (CAS 134793-47-8) is a chemical compound with molecular formula C17H13F3N6O2S3 and molecular weight 486.02142 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[2,4-bis(ethenylcarbamothioyl)-5-oxo-3-sulfanylidene-1,2,4-triazin-6-yl]phenyl]-2,2,2-trifluoroacetamide
Also Known As: 3F-1,2,4-triazine derv., NCI60_006882, Acetamide, N-(2-(2,4-bis((ethenylamino)thioxomethyl)-2,3,4,5-tetrahydro-5-oxo-3-thioxo-1,2,4-triazin-6-yl)phenyl)-2,2,2-trifluoro-, 3-Thioxo-2,4-Di(N-vinylaminothioxomethyl)-6-(2-trifluoroacetylaminophenyl)-1,2,4-triazine-5(2H,4H)-one, ACETAMIDE,N-[2-[2,4-BIS[(ETHENYLAMINO)THIOXOMETHYL]-2,3,4,5-TETRAHYDRO-5-OXO-3-THIOXO-1,2,4-TRIAZIN-6-YL]PHENYL]-2,2,2-TRIFLUORO-
Technical Specifications
| Molecular Formula | C17H13F3N6O2S3 |
| Molecular Weight | 486.02142 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 185.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 486.02142 Da |
| Heavy Atoms | 31 |
| Complexity | 861.0 |
| SMILES | C=CNC(=S)N1C(=O)C(=NN(C1=S)C(=S)NC=C)C2=CC=CC=C2NC(=O)C(F)(F)F |
| InChIKey | FFLNCWNLBCUZJK-UHFFFAOYSA-N |
Chemical Property Profile of K6FZY58H95
Property Insights of K6FZY58H95
The XLogP value of 3.9 indicates that K6FZY58H95 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 185.0 Ų indicates high polarity, suggesting K6FZY58H95 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, K6FZY58H95 has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of K6FZY58H95?
The CAS number of K6FZY58H95 is 134793-47-8.
What is the molecular formula of K6FZY58H95?
The molecular formula of K6FZY58H95 is C17H13F3N6O2S3.
What is the molecular weight of K6FZY58H95?
The molecular weight of K6FZY58H95 is 486.02142 g/mol.
Where can I buy K6FZY58H95?
You can request a quote for K6FZY58H95 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for K6FZY58H95?
Yes, CoreyChem provides custom synthesis services for K6FZY58H95 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.