Di-phthaloyl-cystamine
TL;DR: Di-phthaloyl-cystamine (CAS 109653-49-8) is a chemical compound with molecular formula C20H16N2O4S2 and molecular weight 412.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[2-(1,3-dioxoisoindol-2-yl)ethyldisulfanyl]ethyl]isoindole-1,3-dione
Also Known As: Di-phthaloyl-cystamine, Bis(2-phthalimidoethyl) disulfide, N,N'-(Dithiodiethylene)-diphthalimide, 2-[2-[2-(1,3-dioxoisoindol-2-yl)ethyldisulfanyl]ethyl]isoindole-1,3-dione, 2,2 -(Dithiobisethylene)bis(2H-isoindole-1,3-dione)
| Molecular Formula | C20H16N2O4S2 |
|---|---|
| Molecular Weight | 412.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 412.05515 |
| Heavy Atoms | 28 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 109653-49-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CCSSCCN3C(=O)C4=CC=CC=C4C3=O |
| InChIKey | OOVODYBFEYYJCA-UHFFFAOYSA-N |
Product Overview
Di-phthaloyl-cystamine (CAS 109653-49-8), with molecular formula C20H16N2O4S2 and molecular weight 412.06 g/mol. IUPAC: 2-[2-[2-(1,3-dioxoisoindol-2-yl)ethyldisulfanyl]ethyl]isoindole-1,3-dione.
Chemical Property Profile of Di-phthaloyl-cystamine
Property Insights of Di-phthaloyl-cystamine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Di-phthaloyl-cystamine. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Di-phthaloyl-cystamine. Following Lipinski's Rule of Five, Di-phthaloyl-cystamine has 0 hydrogen bond donor(s) and 6 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 Di-phthaloyl-cystamine?
The CAS number of Di-phthaloyl-cystamine is 109653-49-8.
What is the molecular formula of Di-phthaloyl-cystamine?
The molecular formula of Di-phthaloyl-cystamine is C20H16N2O4S2.
What is the molecular weight of Di-phthaloyl-cystamine?
The molecular weight of Di-phthaloyl-cystamine is 412.06 g/mol.
Where can I buy Di-phthaloyl-cystamine?
You can request a quote for Di-phthaloyl-cystamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Di-phthaloyl-cystamine?
Yes, KEHONG BIO provides custom synthesis services for Di-phthaloyl-cystamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.