RefChem:1058442
TL;DR: RefChem:1058442 (CAS 151539-19-4) is a chemical compound with molecular formula C23H30N4O3 and molecular weight 410.23178 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-[(E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
Also Known As: (E)-8-(4-Methoxy-2,3-dimethylstyryl)-7-methyl-1,3-dipropylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dipropyl-8-(2-(4-methoxy-2,3-dimethylphenyl)ethenyl)-7-methyl-, (E)-, 8-[(E)-2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(4-methoxy-2,3-dimethylphenyl)ethenyl)-7-methyl-1,3-dipropyl-, (E)-, 1H-Purine-2,6-dione, 3,7-dihydro-8-[2-(4-methoxy-2,3-dimethylphenyl)ethenyl]-7-methyl-1,3-dipropyl-, (E)-
Technical Specifications
| Molecular Formula | C23H30N4O3 |
| Molecular Weight | 410.23178 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 67.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.23178 Da |
| Heavy Atoms | 30 |
| Complexity | 654.0 |
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC)N(C(=N2)/C=C/C3=C(C(=C(C=C3)OC)C)C)C |
| InChIKey | AUBIFWCPXCGRBT-ZRDIBKRKSA-N |
Chemical Property Profile of RefChem:1058442
Property Insights of RefChem:1058442
The XLogP value of 4.4 indicates that RefChem:1058442 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058442. Following Lipinski's Rule of Five, RefChem:1058442 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
What is the CAS number of RefChem:1058442?
The CAS number of RefChem:1058442 is 151539-19-4.
What is the molecular formula of RefChem:1058442?
The molecular formula of RefChem:1058442 is C23H30N4O3.
What is the molecular weight of RefChem:1058442?
The molecular weight of RefChem:1058442 is 410.23178 g/mol.
Where can I buy RefChem:1058442?
You can request a quote for RefChem:1058442 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1058442?
Yes, CoreyChem provides custom synthesis services for RefChem:1058442 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.