F1847-0050
TL;DR: F1847-0050 (CAS 869067-79-8) is a chemical compound with molecular formula C13H12F3N5O3S and molecular weight 375.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Also Known As: F1847-0050, 2-[(4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide, 2-((4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)thio)-N-(4-(trifluoromethoxy)phenyl)acetamide, 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide, N-p-trifluoromethoxyphenyl(4-amino-6-methyl-5-oxo-4,5-dihydro-1,2,4-triazin-3-ylthio)acetamide
| Molecular Formula | C13H12F3N5O3S |
|---|---|
| Molecular Weight | 375.06 g/mol |
| LogP | 1.28992 |
| Topological Polar Surface Area | 112.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 375.0613 |
| Heavy Atoms | 25 |
| Complexity | 823.1398 |
Chemical Identifiers
| CAS Number | 869067-79-8 |
|---|---|
| SMILES | CC1=NN=C(N(C1=O)N)SCC(=O)NC2=CC=C(C=C2)OC(F)(F)F |
Product Overview
F1847-0050 (CAS 869067-79-8), with molecular formula C13H12F3N5O3S and molecular weight 375.06 g/mol. IUPAC: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide.
Chemical Property Profile of F1847-0050
Property Insights of F1847-0050
The XLogP value of 1.28992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F1847-0050. The TPSA of 112.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F1847-0050. Following Lipinski's Rule of Five, F1847-0050 has 2 hydrogen bond donor(s) and 7 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 F1847-0050?
The CAS number of F1847-0050 is 869067-79-8.
What is the molecular formula of F1847-0050?
The molecular formula of F1847-0050 is C13H12F3N5O3S.
What is the molecular weight of F1847-0050?
The molecular weight of F1847-0050 is 375.06 g/mol.
Where can I buy F1847-0050?
You can request a quote for F1847-0050 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1847-0050?
Yes, KEHONG BIO provides custom synthesis services for F1847-0050 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.