F0579-0436
TL;DR: F0579-0436 (CAS 686772-47-4) is a chemical compound with molecular formula C23H20N4O3S3 and molecular weight 496.07 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-[[3-(4-ethoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: F0579-0436, N-(1,3-benzothiazol-2-yl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide, N-(benzo[d]thiazol-2-yl)-2-((3-(4-ethoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide, N-(1,3-benzothiazol-2-yl)-2-[[3-(4-ethoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide, N-(1,3-benzothiazol-2-yl)[6-(p-ethoxyphenyl)-7-oxo-1-thia-4,6-diaza-5-indanylthio]acetamide
| Molecular Formula | C23H20N4O3S3 |
|---|---|
| Molecular Weight | 496.07 g/mol |
| LogP | 4.6199 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 496.06976 |
| Heavy Atoms | 33 |
| Complexity | 1349.2283 |
Chemical Identifiers
| CAS Number | 686772-47-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)C3=C(CCS3)N=C2SCC(=O)NC4=NC5=CC=CC=C5S4 |
Product Overview
F0579-0436 (CAS 686772-47-4), with molecular formula C23H20N4O3S3 and molecular weight 496.07 g/mol. IUPAC: N-(1,3-benzothiazol-2-yl)-2-[[3-(4-ethoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of F0579-0436
Property Insights of F0579-0436
The XLogP value of 4.6199 indicates that F0579-0436 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for F0579-0436. Following Lipinski's Rule of Five, F0579-0436 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 F0579-0436?
The CAS number of F0579-0436 is 686772-47-4.
What is the molecular formula of F0579-0436?
The molecular formula of F0579-0436 is C23H20N4O3S3.
What is the molecular weight of F0579-0436?
The molecular weight of F0579-0436 is 496.07 g/mol.
Where can I buy F0579-0436?
You can request a quote for F0579-0436 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0579-0436?
Yes, KEHONG BIO provides custom synthesis services for F0579-0436 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.