F0916-5894
TL;DR: F0916-5894 (CAS 422306-86-3) is a chemical compound with molecular formula C28H23ClN4O3S3 and molecular weight 594.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-2-[[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide
Also Known As: F0916-5894, N-(2-chlorophenyl)-2-{[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-2H,3H,6H,7H-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide, N-(2-chlorophenyl)-2-((6-(2-methoxyphenyl)-7-oxo-3-phenethyl-2-thioxo-2,3,6,7-tetrahydrothiazolo[4,5-d]pyrimidin-5-yl)thio)acetamide, N-(2-chlorophenyl)-2-[[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide, N-(2-chlorophenyl)-2-[[6-(2-methoxyphenyl)-7-oxo-3-phenethyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide
| Molecular Formula | C28H23ClN4O3S3 |
|---|---|
| Molecular Weight | 594.06 g/mol |
| LogP | 6.61369 |
| Topological Polar Surface Area | 78.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 594.0621 |
| Heavy Atoms | 39 |
| Complexity | 1766.0109 |
Chemical Identifiers
| CAS Number | 422306-86-3 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC=C4Cl)N(C(=S)S3)CCC5=CC=CC=C5 |
Product Overview
F0916-5894 (CAS 422306-86-3), with molecular formula C28H23ClN4O3S3 and molecular weight 594.06 g/mol. IUPAC: N-(2-chlorophenyl)-2-[[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]acetamide.
Chemical Property Profile of F0916-5894
Property Insights of F0916-5894
The XLogP value of 6.61369 indicates that F0916-5894 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.15 Ų falls within the moderate polarity range, balancing permeability and solubility for F0916-5894. Following Lipinski's Rule of Five, F0916-5894 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0916-5894?
The CAS number of F0916-5894 is 422306-86-3.
What is the molecular formula of F0916-5894?
The molecular formula of F0916-5894 is C28H23ClN4O3S3.
What is the molecular weight of F0916-5894?
The molecular weight of F0916-5894 is 594.06 g/mol.
Where can I buy F0916-5894?
You can request a quote for F0916-5894 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0916-5894?
Yes, KEHONG BIO provides custom synthesis services for F0916-5894 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.