F0544-0084
TL;DR: F0544-0084 (CAS 450346-79-9) is a chemical compound with molecular formula C15H12ClF3N4O2S2 and molecular weight 436.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
Also Known As: F0544-0084, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide, N-(2-chloro-5-(trifluoromethyl)phenyl)-2-((8-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)thio)acetamide, N-[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]-2-({8-OXO-5H,6H,7H,8H-[1,3,4]THIADIAZOLO[3,2-A][1,3]DIAZEPIN-2-YL}SULFANYL)ACETAMIDE, N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(8-oxo-5,6,7,8-tetrahydro[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)thio]acetamide
| Molecular Formula | C15H12ClF3N4O2S2 |
|---|---|
| Molecular Weight | 436.00 g/mol |
| LogP | 4.0267 |
| Topological Polar Surface Area | 74.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 436.00424 |
| Heavy Atoms | 27 |
| Complexity | 844.8412 |
Chemical Identifiers
| CAS Number | 450346-79-9 |
|---|---|
| SMILES | C1CC(=O)N=C2N(C1)N=C(S2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
F0544-0084 (CAS 450346-79-9), with molecular formula C15H12ClF3N4O2S2 and molecular weight 436.00 g/mol. IUPAC: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of F0544-0084
Property Insights of F0544-0084
The XLogP value of 4.0267 indicates that F0544-0084 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F0544-0084. Following Lipinski's Rule of Five, F0544-0084 has 1 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 F0544-0084?
The CAS number of F0544-0084 is 450346-79-9.
What is the molecular formula of F0544-0084?
The molecular formula of F0544-0084 is C15H12ClF3N4O2S2.
What is the molecular weight of F0544-0084?
The molecular weight of F0544-0084 is 436.00 g/mol.
Where can I buy F0544-0084?
You can request a quote for F0544-0084 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0544-0084?
Yes, KEHONG BIO provides custom synthesis services for F0544-0084 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.