Methyl 4-(6-aminopurin-9-yl)but-2-enoate
TL;DR: Methyl 4-(6-aminopurin-9-yl)but-2-enoate (CAS 33585-01-2) is a chemical compound with molecular formula C10H11N5O2 and molecular weight 233.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(6-aminopurin-9-yl)but-2-enoate
Also Known As: Methyl (E)-4-(6-aminopurin-9-yl)but-2-enoate
| Molecular Formula | C10H11N5O2 |
|---|---|
| Molecular Weight | 233.09 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 95.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 233.09128 |
| Heavy Atoms | 17 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 33585-01-2 |
|---|---|
| SMILES | COC(=O)C=CCN1C=NC2=C(N=CN=C21)N |
| InChIKey | CRXCMEYTAHOHMY-UHFFFAOYSA-N |
Product Overview
Methyl 4-(6-aminopurin-9-yl)but-2-enoate (CAS 33585-01-2), with molecular formula C10H11N5O2 and molecular weight 233.09 g/mol. IUPAC: methyl 4-(6-aminopurin-9-yl)but-2-enoate.
Chemical Property Profile of Methyl 4-(6-aminopurin-9-yl)but-2-enoate
Property Insights of Methyl 4-(6-aminopurin-9-yl)but-2-enoate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(6-aminopurin-9-yl)but-2-enoate. The TPSA of 95.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(6-aminopurin-9-yl)but-2-enoate. Following Lipinski's Rule of Five, Methyl 4-(6-aminopurin-9-yl)but-2-enoate has 1 hydrogen bond donor(s) and 6 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 Methyl 4-(6-aminopurin-9-yl)but-2-enoate?
The CAS number of Methyl 4-(6-aminopurin-9-yl)but-2-enoate is 33585-01-2.
What is the molecular formula of Methyl 4-(6-aminopurin-9-yl)but-2-enoate?
The molecular formula of Methyl 4-(6-aminopurin-9-yl)but-2-enoate is C10H11N5O2.
What is the molecular weight of Methyl 4-(6-aminopurin-9-yl)but-2-enoate?
The molecular weight of Methyl 4-(6-aminopurin-9-yl)but-2-enoate is 233.09 g/mol.
Where can I buy Methyl 4-(6-aminopurin-9-yl)but-2-enoate?
You can request a quote for Methyl 4-(6-aminopurin-9-yl)but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(6-aminopurin-9-yl)but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(6-aminopurin-9-yl)but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.