4J-901
TL;DR: 4J-901 (CAS 318247-36-8) is a chemical compound with molecular formula C17H16N2O8S and molecular weight 408.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 3-[2-(1,3-dioxoisoindol-2-yl)oxyacetyl]-1,3-thiazolidine-2,4-dicarboxylate
Also Known As: 4J-901, Dimethyl 3-[2-(1,3-dioxoisoindol-2-yl)oxyacetyl]-1,3-thiazolidine-2,4-dicarboxylate, dimethyl 3-{2-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]acetyl}-1,3-thiazolane-2,4-dicarboxylate, Dimethyl 3-(2-((1,3-dioxoisoindolin-2-yl)oxy)acetyl)thiazolidine-2,4-dicarboxylate, 2,4-dimethyl 3-{2-[(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)oxy]acetyl}-1,3-thiazolidine-2,4-dicarboxylate
| Molecular Formula | C17H16N2O8S |
|---|---|
| Molecular Weight | 408.06 g/mol |
| LogP | -0.1697 |
| Topological Polar Surface Area | 119.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.06274 |
| Heavy Atoms | 28 |
| Complexity | 798.3141 |
Chemical Identifiers
| CAS Number | 318247-36-8 |
|---|---|
| SMILES | COC(=O)C1CSC(N1C(=O)CON2C(=O)C3=CC=CC=C3C2=O)C(=O)OC |
Product Overview
4J-901 (CAS 318247-36-8), with molecular formula C17H16N2O8S and molecular weight 408.06 g/mol. IUPAC: dimethyl 3-[2-(1,3-dioxoisoindol-2-yl)oxyacetyl]-1,3-thiazolidine-2,4-dicarboxylate.
Chemical Property Profile of 4J-901
Property Insights of 4J-901
The XLogP value of -0.1697 indicates that 4J-901 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 4J-901. Following Lipinski's Rule of Five, 4J-901 has 0 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 4J-901?
The CAS number of 4J-901 is 318247-36-8.
What is the molecular formula of 4J-901?
The molecular formula of 4J-901 is C17H16N2O8S.
What is the molecular weight of 4J-901?
The molecular weight of 4J-901 is 408.06 g/mol.
Where can I buy 4J-901?
You can request a quote for 4J-901 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4J-901?
Yes, KEHONG BIO provides custom synthesis services for 4J-901 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.