(E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine
TL;DR: (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine (CAS 151539-32-1) is a chemical compound with molecular formula C19H21N5O4 and molecular weight 383.15936 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-[(E)-2-(3-nitrophenyl)ethenyl]-1,3-dipropyl-7H-purine-2,6-dione
Also Known As: (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dipropyl-8-(2-(3-nitrophenyl)ethenyl)-, (E)-, (E)-1,3-Dipropyl-8-(2-(3-nitrophenyl)ethenyl)-3,7-dihydro-1H-purine-2,6-dione, Xanthine, 1,3-dipropyl-8-[2-(3-nitrophenyl)ethenyl]-, 8-[(E)-2-(3-nitrophenyl)ethenyl]-1,3-dipropyl-7H-purine-2,6-dione
Technical Specifications
| Molecular Formula | C19H21N5O4 |
| Molecular Weight | 383.15936 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.15936 Da |
| Heavy Atoms | 28 |
| Complexity | 634.0 |
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)/C=C/C3=CC(=CC=C3)[N+](=O)[O-] |
| InChIKey | OQURVXLRSYSXCY-CMDGGOBGSA-N |
Chemical Property Profile of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine
Property Insights of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine
The XLogP value of 4.7 indicates that (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine. Following Lipinski's Rule of Five, (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine?
The CAS number of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine is 151539-32-1.
What is the molecular formula of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine?
The molecular formula of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine is C19H21N5O4.
What is the molecular weight of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine?
The molecular weight of (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine is 383.15936 g/mol.
Where can I buy (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine?
You can request a quote for (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine?
Yes, CoreyChem provides custom synthesis services for (E)-8-(3-Nitrostyryl)-1,3-dipropylxanthine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.