F0596-0014
TL;DR: F0596-0014 (CAS 851130-16-0) is a chemical compound with molecular formula C16H13N5O2S3 and molecular weight 403.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
Also Known As: F0596-0014, N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-{8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5,10,12-hexaen-6-ylsulfanyl}acetamide, 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-(5-(ethylthio)-1,3,4-thiadiazol-2-yl)acetamide, 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
| Molecular Formula | C16H13N5O2S3 |
|---|---|
| Molecular Weight | 403.02 g/mol |
| LogP | 4.0703 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.02313 |
| Heavy Atoms | 26 |
| Complexity | 1078.0719 |
Chemical Identifiers
| CAS Number | 851130-16-0 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)CSC2=NC=NC3=C2OC4=CC=CC=C43 |
Product Overview
F0596-0014 (CAS 851130-16-0), with molecular formula C16H13N5O2S3 and molecular weight 403.02 g/mol. IUPAC: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide.
Chemical Property Profile of F0596-0014
Property Insights of F0596-0014
The XLogP value of 4.0703 indicates that F0596-0014 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for F0596-0014. Following Lipinski's Rule of Five, F0596-0014 has 1 hydrogen bond donor(s) and 9 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 F0596-0014?
The CAS number of F0596-0014 is 851130-16-0.
What is the molecular formula of F0596-0014?
The molecular formula of F0596-0014 is C16H13N5O2S3.
What is the molecular weight of F0596-0014?
The molecular weight of F0596-0014 is 403.02 g/mol.
Where can I buy F0596-0014?
You can request a quote for F0596-0014 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0596-0014?
Yes, KEHONG BIO provides custom synthesis services for F0596-0014 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.