A2814/0118980
TL;DR: A2814/0118980 (CAS 442665-01-2) is a chemical compound with molecular formula C26H29N5O2 and molecular weight 443.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(1-adamantyl)-2,4-dimethyl-6-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: A2814/0118980, 7-(1-adamantyl)-2,4-dimethyl-6-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione, 1,3-dimethyl-8-(4-methylphenyl)-7-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-((3r,5r,7r)-adamantan-1-yl)-1,3-dimethyl-8-(p-tolyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(ADAMANTAN-1-YL)-1,3-DIMETHYL-8-(4-METHYLPHENYL)-1H,2H,3H,4H,8H-IMIDAZO[1,2-G]PURINE-2,4-DIONE
| Molecular Formula | C26H29N5O2 |
|---|---|
| Molecular Weight | 443.23 g/mol |
| LogP | 3.45182 |
| Topological Polar Surface Area | 66.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 443.23212 |
| Heavy Atoms | 33 |
| Complexity | 1527.6996 |
Chemical Identifiers
| CAS Number | 442665-01-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C56CC7CC(C5)CC(C7)C6 |
Product Overview
A2814/0118980 (CAS 442665-01-2), with molecular formula C26H29N5O2 and molecular weight 443.23 g/mol. IUPAC: 7-(1-adamantyl)-2,4-dimethyl-6-(4-methylphenyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of A2814/0118980
Property Insights of A2814/0118980
The XLogP value of 3.45182 indicates that A2814/0118980 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.23 Ų falls within the moderate polarity range, balancing permeability and solubility for A2814/0118980. Following Lipinski's Rule of Five, A2814/0118980 has 0 hydrogen bond donor(s) and 3 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 A2814/0118980?
The CAS number of A2814/0118980 is 442665-01-2.
What is the molecular formula of A2814/0118980?
The molecular formula of A2814/0118980 is C26H29N5O2.
What is the molecular weight of A2814/0118980?
The molecular weight of A2814/0118980 is 443.23 g/mol.
Where can I buy A2814/0118980?
You can request a quote for A2814/0118980 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2814/0118980?
Yes, KEHONG BIO provides custom synthesis services for A2814/0118980 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.