F0470-0047
TL;DR: F0470-0047 (CAS 391868-80-7) is a chemical compound with molecular formula C15H12ClFN6O2S4 and molecular weight 489.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide
Also Known As: F0470-0047, 2-chloro-N-{5-[({[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}methyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-6-fluorobenzamide, 2-chloro-N-(5-((2-((5-(ethylthio)-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-6-fluorobenzamide, 2-chloro-N-[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide
| Molecular Formula | C15H12ClFN6O2S4 |
|---|---|
| Molecular Weight | 489.96 g/mol |
| LogP | 4.2772 |
| Topological Polar Surface Area | 109.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 489.9577 |
| Heavy Atoms | 29 |
| Complexity | 1009.6627 |
Chemical Identifiers
| CAS Number | 391868-80-7 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=C(C=CC=C3Cl)F |
Product Overview
F0470-0047 (CAS 391868-80-7), with molecular formula C15H12ClFN6O2S4 and molecular weight 489.96 g/mol. IUPAC: 2-chloro-N-[5-[2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide.
Chemical Property Profile of F0470-0047
Property Insights of F0470-0047
The XLogP value of 4.2772 indicates that F0470-0047 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 F0470-0047. Following Lipinski's Rule of Five, F0470-0047 has 2 hydrogen bond donor(s) and 10 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 F0470-0047?
The CAS number of F0470-0047 is 391868-80-7.
What is the molecular formula of F0470-0047?
The molecular formula of F0470-0047 is C15H12ClFN6O2S4.
What is the molecular weight of F0470-0047?
The molecular weight of F0470-0047 is 489.96 g/mol.
Where can I buy F0470-0047?
You can request a quote for F0470-0047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0470-0047?
Yes, KEHONG BIO provides custom synthesis services for F0470-0047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.