Adenosine 5'-phospho-2-methylimidazolide
TL;DR: Adenosine 5'-phospho-2-methylimidazolide (CAS 31008-65-8) is a chemical compound with molecular formula C14H18N7O6P and molecular weight 411.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-(2-methylimidazol-1-yl)phosphinic acid
Also Known As: 2-Meimpa, Adenosine 5'-phospho-2-methylimidazolide, Adenosine, 5'-(hydrogen (2-methyl-1H-imidazol-1-yl)phosphonate), 5 -O-[(2-Methyl-1H-imidazole-1-yl)phosphonyl]adenosine, Adenosine 5 -(2-methyl-1H-imidazole-1-yl) phosphonate
| Molecular Formula | C14H18N7O6P |
|---|---|
| Molecular Weight | 411.11 g/mol |
| LogP | -0.80208 |
| Topological Polar Surface Area | 183.66 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 411.10562 |
| Heavy Atoms | 28 |
| Complexity | 1053.911 |
Chemical Identifiers
| CAS Number | 31008-65-8 |
|---|---|
| SMILES | CC1=NC=CN1P(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O |
Product Overview
Adenosine 5'-phospho-2-methylimidazolide (CAS 31008-65-8), with molecular formula C14H18N7O6P and molecular weight 411.11 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-(2-methylimidazol-1-yl)phosphinic acid.
Chemical Property Profile of Adenosine 5'-phospho-2-methylimidazolide
Property Insights of Adenosine 5'-phospho-2-methylimidazolide
The XLogP value of -0.80208 indicates that Adenosine 5'-phospho-2-methylimidazolide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 183.66 Ų indicates high polarity, suggesting Adenosine 5'-phospho-2-methylimidazolide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine 5'-phospho-2-methylimidazolide has 4 hydrogen bond donor(s) and 10 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 Adenosine 5'-phospho-2-methylimidazolide?
The CAS number of Adenosine 5'-phospho-2-methylimidazolide is 31008-65-8.
What is the molecular formula of Adenosine 5'-phospho-2-methylimidazolide?
The molecular formula of Adenosine 5'-phospho-2-methylimidazolide is C14H18N7O6P.
What is the molecular weight of Adenosine 5'-phospho-2-methylimidazolide?
The molecular weight of Adenosine 5'-phospho-2-methylimidazolide is 411.11 g/mol.
Where can I buy Adenosine 5'-phospho-2-methylimidazolide?
You can request a quote for Adenosine 5'-phospho-2-methylimidazolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenosine 5'-phospho-2-methylimidazolide?
Yes, KEHONG BIO provides custom synthesis services for Adenosine 5'-phospho-2-methylimidazolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.