F0544-0050
TL;DR: F0544-0050 (CAS 450346-72-2) is a chemical compound with molecular formula C12H13N5O3S2 and molecular weight 339.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-1,2-oxazol-3-yl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
Also Known As: F0544-0050, N-(5-methyl-1,2-oxazol-3-yl)-2-({8-oxo-5H,6H,7H,8H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl}sulfanyl)acetamide, N-(5-methylisoxazol-3-yl)-2-((8-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)thio)acetamide, N-(5-methyl-1,2-oxazol-3-yl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide, N-(5-methyl-3-isoxazolyl)(7-oxo-1-thia-3,3a,8-triaza-4,5,6,7-tetrahydro-2-azulenylthio)acetamide
| Molecular Formula | C12H13N5O3S2 |
|---|---|
| Molecular Weight | 339.05 g/mol |
| LogP | 1.65092 |
| Topological Polar Surface Area | 100.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.046 |
| Heavy Atoms | 22 |
| Complexity | 669.47394 |
Chemical Identifiers
| CAS Number | 450346-72-2 |
|---|---|
| SMILES | CC1=CC(=NO1)NC(=O)CSC2=NN3CCCC(=O)N=C3S2 |
Product Overview
F0544-0050 (CAS 450346-72-2), with molecular formula C12H13N5O3S2 and molecular weight 339.05 g/mol. IUPAC: N-(5-methyl-1,2-oxazol-3-yl)-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 F0544-0050
Property Insights of F0544-0050
The XLogP value of 1.65092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0544-0050. The TPSA of 100.16 Ų falls within the moderate polarity range, balancing permeability and solubility for F0544-0050. Following Lipinski's Rule of Five, F0544-0050 has 1 hydrogen bond donor(s) and 8 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 F0544-0050?
The CAS number of F0544-0050 is 450346-72-2.
What is the molecular formula of F0544-0050?
The molecular formula of F0544-0050 is C12H13N5O3S2.
What is the molecular weight of F0544-0050?
The molecular weight of F0544-0050 is 339.05 g/mol.
Where can I buy F0544-0050?
You can request a quote for F0544-0050 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0544-0050?
Yes, KEHONG BIO provides custom synthesis services for F0544-0050 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.