Ditalimfos
TL;DR: Ditalimfos (CAS 5131-24-8) is a chemical compound with molecular formula C12H14NO4PS and molecular weight 299.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-diethoxyphosphinothioylisoindole-1,3-dione
Also Known As: Ditalimfos, Millie, Plondrel, Laptran, Frutogard
| Molecular Formula | C12H14NO4PS |
|---|---|
| Molecular Weight | 299.04 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.03812 |
| Heavy Atoms | 19 |
| Complexity | 394.0 |
| Vapor Pressure | 0.00000002 [mmHg] |
Chemical Identifiers
| CAS Number | 5131-24-8 |
|---|---|
| SMILES | CCOP(=S)(N1C(=O)C2=CC=CC=C2C1=O)OCC |
| InChIKey | MTBZIGHNGSTDJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ditalimfos (CAS 5131-24-8), with molecular formula C12H14NO4PS and molecular weight 299.04 g/mol. IUPAC: 2-diethoxyphosphinothioylisoindole-1,3-dione.
Chemical Property Profile of Ditalimfos
Property Insights of Ditalimfos
The XLogP value of 3.5 indicates that Ditalimfos is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ditalimfos. Following Lipinski's Rule of Five, Ditalimfos has 0 hydrogen bond donor(s) and 5 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 Ditalimfos?
The CAS number of Ditalimfos is 5131-24-8.
What is the molecular formula of Ditalimfos?
The molecular formula of Ditalimfos is C12H14NO4PS.
What is the molecular weight of Ditalimfos?
The molecular weight of Ditalimfos is 299.04 g/mol.
Where can I buy Ditalimfos?
You can request a quote for Ditalimfos directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ditalimfos?
Yes, KEHONG BIO provides custom synthesis services for Ditalimfos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.