(E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione
TL;DR: (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione (CAS 155272-07-4) is a chemical compound with molecular formula C22H27BrN4O3 and molecular weight 474.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-[4-(4-bromobutoxy)phenyl]ethenyl]-1,3-diethyl-7-methylpurine-2,6-dione
Also Known As: (E)-8-(4-(4-bromobutoxy)styryl)-1,3-diethyl-7-methylxanthine, (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione, 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-(4-bromobutoxy)phenyl)ethenyl)-1,3-diethyl-7-methyl-,(E)-, 8-[(1E)-2-[4-(4-bromobutoxy)phenyl]ethenyl]-1,3-diethyl-7-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C22H27BrN4O3 |
|---|---|
| Molecular Weight | 474.13 g/mol |
| LogP | 3.6608 |
| Topological Polar Surface Area | 71.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.12665 |
| Heavy Atoms | 30 |
| Complexity | 1156.315 |
Chemical Identifiers
| CAS Number | 155272-07-4 |
|---|---|
| SMILES | CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)C=CC3=CC=C(C=C3)OCCCCBr)C |
Product Overview
(E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione (CAS 155272-07-4), with molecular formula C22H27BrN4O3 and molecular weight 474.13 g/mol. IUPAC: 8-[2-[4-(4-bromobutoxy)phenyl]ethenyl]-1,3-diethyl-7-methylpurine-2,6-dione.
Chemical Property Profile of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione
Property Insights of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione
The XLogP value of 3.6608 indicates that (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.05 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione. Following Lipinski's Rule of Five, (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione has 0 hydrogen bond donor(s) and 4 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 (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione?
The CAS number of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione is 155272-07-4.
What is the molecular formula of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular formula of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione is C22H27BrN4O3.
What is the molecular weight of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione?
The molecular weight of (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione is 474.13 g/mol.
Where can I buy (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione?
You can request a quote for (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-8-(4-(4-Bromobutoxy)styryl)-1,3-diethyl-7-methyl-1H-purine-2,6(3H,7H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.