![5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine structure](/static/products/1236/123642-27-3.webp)
5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine
TL;DR: 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine (CAS 123642-27-3) is a chemical compound with molecular formula C15H23N7O3 and molecular weight 349.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4R,5R)-2-[[4-aminobut-2-enyl(methyl)amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol
Also Known As: Abeado, MDL 73811, 5'-[(4-amino-2-butenyl)methylamino]-5'-deoxyadenosine, 5'-(((Z)-4-Amino-2-butenyl)methylamino)-5'-deoxyadenosine, Adenosine,5'-[[(2Z)-4-amino-2-buten-1-yl]methylamino]-5'-deoxy-
| Molecular Formula | C15H23N7O3 |
|---|---|
| Molecular Weight | 349.19 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.18625 |
| Heavy Atoms | 25 |
| Complexity | 468.0 |
Chemical Identifiers
| CAS Number | 123642-27-3 |
|---|---|
| SMILES | CN(CC=CCN)C[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | YWJCZGDVJQLZET-SDBHATRESA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine (CAS 123642-27-3), with molecular formula C15H23N7O3 and molecular weight 349.19 g/mol. IUPAC: (2R,3S,4R,5R)-2-[[4-aminobut-2-enyl(methyl)amino]methyl]-5-(6-aminopurin-9-yl)oxolane-3,4-diol.
Chemical Property Profile of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine
Property Insights of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine
The XLogP value of -1.5 indicates that 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 149.0 Ų indicates high polarity, suggesting 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine 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 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine?
The CAS number of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine is 123642-27-3.
What is the molecular formula of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine?
The molecular formula of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine is C15H23N7O3.
What is the molecular weight of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine?
The molecular weight of 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine is 349.19 g/mol.
Where can I buy 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine?
You can request a quote for 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine?
Yes, KEHONG BIO provides custom synthesis services for 5'-[(4-Amino-2-butenyl)methylamino]-5'-deoxyadenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.