A2839/0119822
TL;DR: A2839/0119822 (CAS 442668-97-5) is a chemical compound with molecular formula C27H28ClN5O4 and molecular weight 521.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-chlorophenyl)-6-[2-(3,4-diethoxyphenyl)ethyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione
Also Known As: A2839/0119822, 7-(4-chlorophenyl)-6-[2-(3,4-diethoxyphenyl)ethyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione, 7-(4-chlorophenyl)-8-(3,4-diethoxyphenethyl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 7-(4-CHLOROPHENYL)-8-[2-(3,4-DIETHOXYPHENYL)ETHYL]-1,3-DIMETHYL-1H,2H,3H,4H,8H-IMIDAZO[1,2-G]PURINE-2,4-DIONE, 7-(4-chlorophenyl)-8-[2-(3,4-diethoxyphenyl)ethyl]-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
| Molecular Formula | C27H28ClN5O4 |
|---|---|
| Molecular Weight | 521.18 g/mol |
| LogP | 4.0469 |
| Topological Polar Surface Area | 84.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 521.183 |
| Heavy Atoms | 37 |
| Complexity | 1726.927 |
Chemical Identifiers
| CAS Number | 442668-97-5 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CCN2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C5=CC=C(C=C5)Cl)OCC |
Product Overview
A2839/0119822 (CAS 442668-97-5), with molecular formula C27H28ClN5O4 and molecular weight 521.18 g/mol. IUPAC: 7-(4-chlorophenyl)-6-[2-(3,4-diethoxyphenyl)ethyl]-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of A2839/0119822
Property Insights of A2839/0119822
The XLogP value of 4.0469 indicates that A2839/0119822 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 A2839/0119822. Following Lipinski's Rule of Five, A2839/0119822 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 A2839/0119822?
The CAS number of A2839/0119822 is 442668-97-5.
What is the molecular formula of A2839/0119822?
The molecular formula of A2839/0119822 is C27H28ClN5O4.
What is the molecular weight of A2839/0119822?
The molecular weight of A2839/0119822 is 521.18 g/mol.
Where can I buy A2839/0119822?
You can request a quote for A2839/0119822 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2839/0119822?
Yes, KEHONG BIO provides custom synthesis services for A2839/0119822 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.