ethyl 2-((9H-purin-6-yl)amino)acetate
TL;DR: ethyl 2-((9H-purin-6-yl)amino)acetate (CAS 15846-67-0) is a chemical compound with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(7H-purin-6-ylamino)acetate
Also Known As: ethyl N-9H-purin-6-ylglycinate, ethyl 2-((9H-purin-6-yl)amino)acetate, ethyl 2-(purin-6-ylamino)acetate, ethyl 2-(7H-purin-6-ylamino)acetate, Glycine, N-(9H-purin-6-yl)-, ethyl ester
| Molecular Formula | C9H11N5O2 |
|---|---|
| Molecular Weight | 221.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 92.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.09128 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 15846-67-0 |
|---|---|
| SMILES | CCOC(=O)CNC1=NC=NC2=C1NC=N2 |
| InChIKey | FRWPZDCYVQSDRP-UHFFFAOYSA-N |
Product Overview
ethyl 2-((9H-purin-6-yl)amino)acetate (CAS 15846-67-0), with molecular formula C9H11N5O2 and molecular weight 221.09 g/mol. IUPAC: ethyl 2-(7H-purin-6-ylamino)acetate.
Chemical Property Profile of ethyl 2-((9H-purin-6-yl)amino)acetate
Property Insights of ethyl 2-((9H-purin-6-yl)amino)acetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-((9H-purin-6-yl)amino)acetate. The TPSA of 92.8 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-((9H-purin-6-yl)amino)acetate. Following Lipinski's Rule of Five, ethyl 2-((9H-purin-6-yl)amino)acetate has 2 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 ethyl 2-((9H-purin-6-yl)amino)acetate?
The CAS number of ethyl 2-((9H-purin-6-yl)amino)acetate is 15846-67-0.
What is the molecular formula of ethyl 2-((9H-purin-6-yl)amino)acetate?
The molecular formula of ethyl 2-((9H-purin-6-yl)amino)acetate is C9H11N5O2.
What is the molecular weight of ethyl 2-((9H-purin-6-yl)amino)acetate?
The molecular weight of ethyl 2-((9H-purin-6-yl)amino)acetate is 221.09 g/mol.
Where can I buy ethyl 2-((9H-purin-6-yl)amino)acetate?
You can request a quote for ethyl 2-((9H-purin-6-yl)amino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-((9H-purin-6-yl)amino)acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-((9H-purin-6-yl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.