A2815/0118996
TL;DR: A2815/0118996 (CAS 384375-65-9) is a chemical compound with molecular formula C31H39N5O4 and molecular weight 545.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(1-adamantyl)-6-[2-(3,4-diethoxyphenyl)ethyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: A2815/0118996, 7-((3r,5r,7r)-adamantan-1-yl)-8-(3,4-diethoxyphenethyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(1-adamantyl)-6-[2-(3,4-diethoxyphenyl)ethyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione, 7-(1-adamantyl)-8-[2-(3,4-diethoxyphenyl)ethyl]-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(ADAMANTAN-1-YL)-8-[2-(3,4-DIETHOXYPHENYL)ETHYL]-1,3-DIMETHYL-1H,2H,3H,4H,8H-IMIDAZO[1,2-G]PURINE-2,4-DIONE
| Molecular Formula | C31H39N5O4 |
|---|---|
| Molecular Weight | 545.30 g/mol |
| LogP | 4.1943 |
| Topological Polar Surface Area | 84.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 545.30023 |
| Heavy Atoms | 40 |
| Complexity | 1703.2716 |
Chemical Identifiers
| CAS Number | 384375-65-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CCN2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C56CC7CC(C5)CC(C7)C6)OCC |
Product Overview
A2815/0118996 (CAS 384375-65-9), with molecular formula C31H39N5O4 and molecular weight 545.30 g/mol. IUPAC: 7-(1-adamantyl)-6-[2-(3,4-diethoxyphenyl)ethyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of A2815/0118996
Property Insights of A2815/0118996
The XLogP value of 4.1943 indicates that A2815/0118996 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.69 Ų falls within the moderate polarity range, balancing permeability and solubility for A2815/0118996. Following Lipinski's Rule of Five, A2815/0118996 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2815/0118996?
The CAS number of A2815/0118996 is 384375-65-9.
What is the molecular formula of A2815/0118996?
The molecular formula of A2815/0118996 is C31H39N5O4.
What is the molecular weight of A2815/0118996?
The molecular weight of A2815/0118996 is 545.30 g/mol.
Where can I buy A2815/0118996?
You can request a quote for A2815/0118996 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2815/0118996?
Yes, KEHONG BIO provides custom synthesis services for A2815/0118996 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.