N(6)-(2-carboxyethyl)adenine
TL;DR: N(6)-(2-carboxyethyl)adenine (CAS 73094-99-2) is a chemical compound with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(7H-purin-6-ylamino)propanoic acid
Also Known As: N(6)-(2-Carboxyethyl)adenine, 3-(7H-purin-6-ylamino)propanoic acid, NCIStruc1_000604, 3-((9H-Purin-6-yl)amino)propanoic acid, 3-(9H-Purin-6-ylamino)-propionic acid
| Molecular Formula | C8H9N5O2 |
|---|---|
| Molecular Weight | 207.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 207.07562 |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 73094-99-2 |
|---|---|
| SMILES | C1=NC2=C(N1)C(=NC=N2)NCCC(=O)O |
| InChIKey | ALBHTZMRHDQGAA-UHFFFAOYSA-N |
Product Overview
N(6)-(2-carboxyethyl)adenine (CAS 73094-99-2), with molecular formula C8H9N5O2 and molecular weight 207.08 g/mol. IUPAC: 3-(7H-purin-6-ylamino)propanoic acid.
Chemical Property Profile of N(6)-(2-carboxyethyl)adenine
Property Insights of N(6)-(2-carboxyethyl)adenine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(6)-(2-carboxyethyl)adenine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N(6)-(2-carboxyethyl)adenine. Following Lipinski's Rule of Five, N(6)-(2-carboxyethyl)adenine has 3 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 N(6)-(2-carboxyethyl)adenine?
The CAS number of N(6)-(2-carboxyethyl)adenine is 73094-99-2.
What is the molecular formula of N(6)-(2-carboxyethyl)adenine?
The molecular formula of N(6)-(2-carboxyethyl)adenine is C8H9N5O2.
What is the molecular weight of N(6)-(2-carboxyethyl)adenine?
The molecular weight of N(6)-(2-carboxyethyl)adenine is 207.08 g/mol.
Where can I buy N(6)-(2-carboxyethyl)adenine?
You can request a quote for N(6)-(2-carboxyethyl)adenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(6)-(2-carboxyethyl)adenine?
Yes, KEHONG BIO provides custom synthesis services for N(6)-(2-carboxyethyl)adenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.