F0470-0054
TL;DR: F0470-0054 (CAS 391868-85-2) is a chemical compound with molecular formula C16H13F3N6O2S4 and molecular weight 505.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
Also Known As: F0470-0054, N-{5-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-2-(trifluoromethyl)benzamide, N-(5-((2-((5-(ethylthio)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-2-(trifluoromethyl)benzamide, N-[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide
| Molecular Formula | C16H13F3N6O2S4 |
|---|---|
| Molecular Weight | 505.99 g/mol |
| LogP | 4.5035 |
| Topological Polar Surface Area | 109.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.9935 |
| Heavy Atoms | 31 |
| Complexity | 1071.5586 |
Chemical Identifiers
| CAS Number | 391868-85-2 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CC=C3C(F)(F)F |
Product Overview
F0470-0054 (CAS 391868-85-2), with molecular formula C16H13F3N6O2S4 and molecular weight 505.99 g/mol. IUPAC: N-[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-2-(trifluoromethyl)benzamide.
Chemical Property Profile of F0470-0054
Property Insights of F0470-0054
The XLogP value of 4.5035 indicates that F0470-0054 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.76 Ų falls within the moderate polarity range, balancing permeability and solubility for F0470-0054. Following Lipinski's Rule of Five, F0470-0054 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0470-0054?
The CAS number of F0470-0054 is 391868-85-2.
What is the molecular formula of F0470-0054?
The molecular formula of F0470-0054 is C16H13F3N6O2S4.
What is the molecular weight of F0470-0054?
The molecular weight of F0470-0054 is 505.99 g/mol.
Where can I buy F0470-0054?
You can request a quote for F0470-0054 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0470-0054?
Yes, KEHONG BIO provides custom synthesis services for F0470-0054 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.