1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate
TL;DR: 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate (CAS 5453-22-5) is a chemical compound with molecular formula C11H11N6O6P and molecular weight 354.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R,7R)-6-(3,5,7,8,9,12-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2(6),3,7,10-pentaen-5-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
Also Known As: 2-Aza-epsilon-cAMP, 2-Aza--cAMP, Sid 768641, KST-1A5841, 1,N(6)-Etheno-2-azaadenosine 3',5'-monophosphate
| Molecular Formula | C11H11N6O6P |
|---|---|
| Molecular Weight | 354.05 g/mol |
| LogP | -2.6 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.04776 |
| Heavy Atoms | 24 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 5453-22-5 |
|---|---|
| SMILES | C1C2C([C@H]([C@@H](O2)N3C=NC4=C3N=NN5C4=NC=C5)O)OP(=O)(O1)O |
| InChIKey | SWFIGDRXLWNILX-CQVXPMKFSA-N |
Product Overview
1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate (CAS 5453-22-5), with molecular formula C11H11N6O6P and molecular weight 354.05 g/mol. IUPAC: (6R,7R)-6-(3,5,7,8,9,12-hexazatricyclo[7.3.0.02,6]dodeca-1(12),2(6),3,7,10-pentaen-5-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol.
Chemical Property Profile of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate
Property Insights of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate
The XLogP value of -2.6 indicates that 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate has 2 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 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate?
The CAS number of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate is 5453-22-5.
What is the molecular formula of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate?
The molecular formula of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate is C11H11N6O6P.
What is the molecular weight of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate?
The molecular weight of 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate is 354.05 g/mol.
Where can I buy 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate?
You can request a quote for 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate?
Yes, KEHONG BIO provides custom synthesis services for 1,N(6)-etheno-2-azaadenosine 3',5'-monophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.