RefChem:371441
TL;DR: RefChem:371441 (CAS 63717-24-8) is a chemical compound with molecular formula C10H36N4O11P2S2 and molecular weight 514.1297 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-[(3-amino-2-hydroxypropyl)amino]ethylsulfanylphosphonic acid);trihydrate
Also Known As: C5H15N2O4PS.3/2H2O, C5-H15-N2-O4-P-S.3/2H2-O, S-2-(3-Amino-2-hydroxypropylamino)ethyl dihydrogen phosphorothioate sesquihydrate, Phosphorothioic acid, S-((2-(3-amino-2-hydroxy)propylamino)ethyl) ester, sesquihydrate, s-{2-[(3-amino-2-hydroxypropyl)amino]ethyl} dihydrogen phosphorothioate hydrate(2:3)
Technical Specifications
| Molecular Formula | C10H36N4O11P2S2 |
| Molecular Weight | 514.1297 g/mol |
| XLogP | -5.03 |
| Topological Polar Surface Area (TPSA) | 285.0 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 14 |
| Exact Mass | 514.1297 Da |
| Heavy Atoms | 29 |
| Complexity | 176.0 |
| SMILES | C(CSP(=O)(O)O)NCC(CN)O.C(CSP(=O)(O)O)NCC(CN)O.O.O.O |
| InChIKey | HEKZZKQGNORJMJ-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:371441
Property Insights of RefChem:371441
The XLogP value of -5.03 indicates that RefChem:371441 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 285.0 Ų indicates high polarity, suggesting RefChem:371441 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:371441 has 13 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:371441?
The CAS number of RefChem:371441 is 63717-24-8.
What is the molecular formula of RefChem:371441?
The molecular formula of RefChem:371441 is C10H36N4O11P2S2.
What is the molecular weight of RefChem:371441?
The molecular weight of RefChem:371441 is 514.1297 g/mol.
Where can I buy RefChem:371441?
You can request a quote for RefChem:371441 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:371441?
Yes, CoreyChem provides custom synthesis services for RefChem:371441 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.