9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine
TL;DR: 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine (CAS 92999-29-6) is a chemical compound with molecular formula C9H14N5O5P and molecular weight 303.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-1-(6-aminopurin-9-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid
Also Known As: HPMPA, (S)-HPMPA, GS57, N-(2-Phosphonomethoxyethyladenine), 9-(3-Hydroxy-2-phosphonylmethoxypropyl)adenine
| Molecular Formula | C9H14N5O5P |
|---|---|
| Molecular Weight | 303.07 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 157.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 303.07324 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 92999-29-6 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)C[C@@H](CO)OCP(=O)(O)O)N |
| InChIKey | FRPXSOOHWNMLPH-LURJTMIESA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine (CAS 92999-29-6), with molecular formula C9H14N5O5P and molecular weight 303.07 g/mol. IUPAC: [(2S)-1-(6-aminopurin-9-yl)-3-hydroxypropan-2-yl]oxymethylphosphonic acid.
Chemical Property Profile of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine
Property Insights of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine
The XLogP value of -2.6 indicates that 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 157.0 Ų indicates high polarity, suggesting 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine has 4 hydrogen bond donor(s) and 9 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 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine?
The CAS number of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine is 92999-29-6.
What is the molecular formula of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine?
The molecular formula of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine is C9H14N5O5P.
What is the molecular weight of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine?
The molecular weight of 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine is 303.07 g/mol.
Where can I buy 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine?
You can request a quote for 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine?
Yes, KEHONG BIO provides custom synthesis services for 9-((S)-3-Hydroxy-2-(phosphonomethoxy)propyl)adenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.