2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid
TL;DR: 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid (CAS 850718-84-2) is a chemical compound with molecular formula C9H11N5O4 and molecular weight 253.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,7-dimethyl-2,6-dioxopurin-8-yl)amino]acetic acid
Also Known As: SDCCGMLS-0065738.P001, VU0512698-1, 2-[(3,7-dimethyl-2,6-dioxopurin-8-yl)amino]acetic acid, 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid, AB00683398-01
| Molecular Formula | C9H11N5O4 |
|---|---|
| Molecular Weight | 253.08 g/mol |
| LogP | -1.5432 |
| Topological Polar Surface Area | 122.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.0811 |
| Heavy Atoms | 18 |
| Complexity | 737.72156 |
Chemical Identifiers
| CAS Number | 850718-84-2 |
|---|---|
| SMILES | CN1C2=C(N=C1NCC(=O)O)N(C(=O)NC2=O)C |
Product Overview
2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid (CAS 850718-84-2), with molecular formula C9H11N5O4 and molecular weight 253.08 g/mol. IUPAC: 2-[(3,7-dimethyl-2,6-dioxopurin-8-yl)amino]acetic acid.
Chemical Property Profile of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid
Property Insights of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid
The XLogP value of -1.5432 indicates that 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid. Following Lipinski's Rule of Five, 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid has 3 hydrogen bond donor(s) and 5 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 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid?
The CAS number of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid is 850718-84-2.
What is the molecular formula of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid?
The molecular formula of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid is C9H11N5O4.
What is the molecular weight of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid?
The molecular weight of 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid is 253.08 g/mol.
Where can I buy 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid?
You can request a quote for 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-((3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)amino)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.