RefChem:1058270
TL;DR: RefChem:1058270 (CAS 155271-04-8) is a chemical compound with molecular formula C20H24N4O5 and molecular weight 400.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diethyl-8-[(E)-2-(2,3,4-trimethoxyphenyl)ethenyl]-7H-purine-2,6-dione
Also Known As: (E)-1,3-Diethyl-8-(2,3,4-trimethoxystyryl)xanthine, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(2,3,4-trimethoxyphenyl)ethenyl)-, (E)-, (E)-1,3-Diethyl-8-(2-(2,3,4-trimethoxyphenyl)ethenyl)-3,7-dihydro-1H-purine-2,6-dione, 1,3-diethyl-8-[(E)-2-(2,3,4-trimethoxyphenyl)ethenyl]-7H-purine-2,6-dione, RefChem:1058270
| Molecular Formula | C20H24N4O5 |
|---|---|
| Molecular Weight | 400.17 g/mol |
| LogP | 2.1223 |
| Topological Polar Surface Area | 100.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 400.17468 |
| Heavy Atoms | 29 |
| Complexity | 1186.2704 |
Chemical Identifiers
| CAS Number | 155271-04-8 |
|---|---|
| SMILES | CCN1C2=C(C(=O)N(C1=O)CC)NC(=N2)/C=C/C3=C(C(=C(C=C3)OC)OC)OC |
Product Overview
RefChem:1058270 (CAS 155271-04-8), with molecular formula C20H24N4O5 and molecular weight 400.17 g/mol. IUPAC: 1,3-diethyl-8-[(E)-2-(2,3,4-trimethoxyphenyl)ethenyl]-7H-purine-2,6-dione.
Chemical Property Profile of RefChem:1058270
Property Insights of RefChem:1058270
The XLogP value of 2.1223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1058270. The TPSA of 100.37 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058270. Following Lipinski's Rule of Five, RefChem:1058270 has 1 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 RefChem:1058270?
The CAS number of RefChem:1058270 is 155271-04-8.
What is the molecular formula of RefChem:1058270?
The molecular formula of RefChem:1058270 is C20H24N4O5.
What is the molecular weight of RefChem:1058270?
The molecular weight of RefChem:1058270 is 400.17 g/mol.
Where can I buy RefChem:1058270?
You can request a quote for RefChem:1058270 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058270?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058270 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.