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Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate
TL;DR: Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate (CAS 121368-58-9) is a chemical compound with molecular formula C5H13NNa2O7P2 and molecular weight 307.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;[3-(dimethylamino)-1-hydroxy-1-phosphonatopropyl]phosphonic acid
Also Known As: Dimethyl APD, Olpadronate sodium, Sodium olpadronate, Olpadronate disodium, IG 8801
| Molecular Formula | C5H13NNa2O7P2 |
|---|---|
| Molecular Weight | 307.00 g/mol |
| LogP | -8.3164 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.99628 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 121368-58-9 |
|---|---|
| SMILES | CN(C)CCC(O)(P(=O)(O)O)P(=O)([O-])[O-].[Na+].[Na+] |
| InChIKey | JFGHPLSPUGOSLV-UHFFFAOYSA-L |
Product Overview
Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate (CAS 121368-58-9), with molecular formula C5H13NNa2O7P2 and molecular weight 307.00 g/mol. IUPAC: disodium;[3-(dimethylamino)-1-hydroxy-1-phosphonatopropyl]phosphonic acid.
Chemical Property Profile of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate
Property Insights of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate
The XLogP value of -8.3164 indicates that Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate 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 Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate?
The CAS number of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate is 121368-58-9.
What is the molecular formula of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate?
The molecular formula of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate is C5H13NNa2O7P2.
What is the molecular weight of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate?
The molecular weight of Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate is 307.00 g/mol.
Where can I buy Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate?
You can request a quote for Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Disodium [3-(dimethylamino)-1-hydroxy-1-phosphonopropyl]phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.