Org 8764
TL;DR: Org 8764 (CAS 13389-15-6) is a chemical compound with molecular formula C10H20Cl2N3O4PS and molecular weight 379.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxyethyl]-1,3-thiazolidine-4-carboxylic acid
Also Known As: Org 8764, Thiazolidinylethyl N-mustard phosphoramide ester, 2-[2-({amino[bis(2-chloroethyl)amino]phosphoryl}oxy)ethyl]-1,3-thiazolidine-4-carboxylic acid, 2-[2-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxyethyl]-1,3-thiazolidine-4-carboxylic acid, 4-Thiazolidinecarboxylicacid, 2-[2-[[amino[bis(2-chloroethyl)amino]phosphinyl]oxy]ethyl]-
| Molecular Formula | C10H20Cl2N3O4PS |
|---|---|
| Molecular Weight | 379.03 g/mol |
| LogP | -2.0 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 379.02893 |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 13389-15-6 |
|---|---|
| SMILES | C1C(NC(S1)CCOP(=O)(N)N(CCCl)CCCl)C(=O)O |
| InChIKey | KEPIZHRUELMLLO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Org 8764 (CAS 13389-15-6), with molecular formula C10H20Cl2N3O4PS and molecular weight 379.03 g/mol. IUPAC: 2-[2-[amino-[bis(2-chloroethyl)amino]phosphoryl]oxyethyl]-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of Org 8764
Property Insights of Org 8764
The XLogP value of -2.0 indicates that Org 8764 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Org 8764. Following Lipinski's Rule of Five, Org 8764 has 3 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 Org 8764?
The CAS number of Org 8764 is 13389-15-6.
What is the molecular formula of Org 8764?
The molecular formula of Org 8764 is C10H20Cl2N3O4PS.
What is the molecular weight of Org 8764?
The molecular weight of Org 8764 is 379.03 g/mol.
Where can I buy Org 8764?
You can request a quote for Org 8764 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Org 8764?
Yes, KEHONG BIO provides custom synthesis services for Org 8764 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.