F0544-0047
TL;DR: F0544-0047 (CAS 497063-76-0) is a chemical compound with molecular formula C15H13N5O2S3 and molecular weight 391.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzothiazol-2-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: F0544-0047, N-(1,3-benzothiazol-2-yl)-2-({8-oxo-5H,6H,7H,8H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl}sulfanyl)acetamide, N-(benzo[d]thiazol-2-yl)-2-((8-oxo-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)thio)acetamide, N-(1,3-benzothiazol-2-yl)-2-[(8-oxo-6,7-dihydro-5H-[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]acetamide
| Molecular Formula | C15H13N5O2S3 |
|---|---|
| Molecular Weight | 391.02 g/mol |
| LogP | 2.9642 |
| Topological Polar Surface Area | 87.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 391.02313 |
| Heavy Atoms | 25 |
| Complexity | 874.4588 |
Chemical Identifiers
| CAS Number | 497063-76-0 |
|---|---|
| SMILES | C1CC(=O)N=C2N(C1)N=C(S2)SCC(=O)NC3=NC4=CC=CC=C4S3 |
Product Overview
F0544-0047 (CAS 497063-76-0), with molecular formula C15H13N5O2S3 and molecular weight 391.02 g/mol. IUPAC: N-(1,3-benzothiazol-2-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 F0544-0047
Property Insights of F0544-0047
The XLogP value of 2.9642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0544-0047. The TPSA of 87.02 Ų falls within the moderate polarity range, balancing permeability and solubility for F0544-0047. Following Lipinski's Rule of Five, F0544-0047 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 F0544-0047?
The CAS number of F0544-0047 is 497063-76-0.
What is the molecular formula of F0544-0047?
The molecular formula of F0544-0047 is C15H13N5O2S3.
What is the molecular weight of F0544-0047?
The molecular weight of F0544-0047 is 391.02 g/mol.
Where can I buy F0544-0047?
You can request a quote for F0544-0047 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0544-0047?
Yes, KEHONG BIO provides custom synthesis services for F0544-0047 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.