Sodium picofosfate
TL;DR: Sodium picofosfate (CAS 36175-05-0) is a chemical compound with molecular formula C18H17NNaO8P2+ and molecular weight 460.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium [4-[(4-phosphonooxyphenyl)-pyridin-2-ylmethyl]phenyl] dihydrogen phosphate
Also Known As: Sodium picofosfate, sodium [4-[(4-phosphonooxyphenyl)-pyridin-2-ylmethyl]phenyl] dihydrogen phosphate
| Molecular Formula | C18H17NNaO8P2+ |
|---|---|
| Molecular Weight | 460.03 g/mol |
| LogP | 0.2088 |
| Topological Polar Surface Area | 146.41 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.0327 |
| Heavy Atoms | 30 |
| Complexity | 984.3092 |
Chemical Identifiers
| CAS Number | 36175-05-0 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(C2=CC=C(C=C2)OP(=O)(O)O)C3=CC=C(C=C3)OP(=O)(O)O.[Na+] |
Product Overview
Sodium picofosfate (CAS 36175-05-0), with molecular formula C18H17NNaO8P2+ and molecular weight 460.03 g/mol. IUPAC: sodium [4-[(4-phosphonooxyphenyl)-pyridin-2-ylmethyl]phenyl] dihydrogen phosphate.
Chemical Property Profile of Sodium picofosfate
Property Insights of Sodium picofosfate
The XLogP value of 0.2088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sodium picofosfate. The TPSA of 146.41 Ų indicates high polarity, suggesting Sodium picofosfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sodium picofosfate has 4 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 Sodium picofosfate?
The CAS number of Sodium picofosfate is 36175-05-0.
What is the molecular formula of Sodium picofosfate?
The molecular formula of Sodium picofosfate is C18H17NNaO8P2+.
What is the molecular weight of Sodium picofosfate?
The molecular weight of Sodium picofosfate is 460.03 g/mol.
Where can I buy Sodium picofosfate?
You can request a quote for Sodium picofosfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium picofosfate?
Yes, KEHONG BIO provides custom synthesis services for Sodium picofosfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.