2-(m-Nitrophenyl)adenosine
TL;DR: 2-(m-Nitrophenyl)adenosine (CAS 109875-47-0) is a chemical compound with molecular formula C16H16N6O6 and molecular weight 388.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R)-2-[6-amino-2-(3-nitrophenyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 2-(m-Nitrophenyl)adenosine, 2-(3-NITROPHENYL)ADENOSINE, Adenosine, 2-(3-nitrophenyl)-, 2-(META-NITROPHENYL)-ADENOSINE, Adenosine,2-(3-nitrophenyl)-(9CI)
| Molecular Formula | C16H16N6O6 |
|---|---|
| Molecular Weight | 388.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 185.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 388.11313 |
| Heavy Atoms | 28 |
| Complexity | 580.0 |
Chemical Identifiers
| CAS Number | 109875-47-0 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC(=C3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
| InChIKey | ACAOMVAOUMITTJ-UBEDBUPSSA-N |
Product Overview
2-(m-Nitrophenyl)adenosine (CAS 109875-47-0), with molecular formula C16H16N6O6 and molecular weight 388.11 g/mol. IUPAC: (2R,3R,4S,5R)-2-[6-amino-2-(3-nitrophenyl)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 2-(m-Nitrophenyl)adenosine
Property Insights of 2-(m-Nitrophenyl)adenosine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(m-Nitrophenyl)adenosine. The TPSA of 185.0 Ų indicates high polarity, suggesting 2-(m-Nitrophenyl)adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(m-Nitrophenyl)adenosine 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 2-(m-Nitrophenyl)adenosine?
The CAS number of 2-(m-Nitrophenyl)adenosine is 109875-47-0.
What is the molecular formula of 2-(m-Nitrophenyl)adenosine?
The molecular formula of 2-(m-Nitrophenyl)adenosine is C16H16N6O6.
What is the molecular weight of 2-(m-Nitrophenyl)adenosine?
The molecular weight of 2-(m-Nitrophenyl)adenosine is 388.11 g/mol.
Where can I buy 2-(m-Nitrophenyl)adenosine?
You can request a quote for 2-(m-Nitrophenyl)adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(m-Nitrophenyl)adenosine?
Yes, KEHONG BIO provides custom synthesis services for 2-(m-Nitrophenyl)adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.