RefChem:1058407
TL;DR: RefChem:1058407 (CAS 151539-33-2) is a chemical compound with molecular formula C19H21ClN4O2 and molecular weight 372.1353 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-[(E)-2-(2-chlorophenyl)ethenyl]-1,3-dipropyl-7H-purine-2,6-dione
Also Known As: (E)-8-(2-Chlorostyryl)-1,3-dipropylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(2-chlorophenyl)ethenyl)-1,3-dipropyl-, (E)-, (E)-8-(2-(2-Chlorophenyl)ethenyl)-1,3-dipropyl-3,7-dihydro-1H-purine-2,6-dione, 8-[(E)-2-(2-chlorophenyl)ethenyl]-1,3-dipropyl-7H-purine-2,6-dione
Technical Specifications
| Molecular Formula | C19H21ClN4O2 |
| Molecular Weight | 372.1353 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 372.1353 Da |
| Heavy Atoms | 26 |
| Complexity | 556.0 |
| SMILES | CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)/C=C/C3=CC=CC=C3Cl |
| InChIKey | LXLBXTUISMUEEF-MDZDMXLPSA-N |
Chemical Property Profile of RefChem:1058407
Property Insights of RefChem:1058407
The XLogP value of 5.5 indicates that RefChem:1058407 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058407. Following Lipinski's Rule of Five, RefChem:1058407 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of RefChem:1058407?
The CAS number of RefChem:1058407 is 151539-33-2.
What is the molecular formula of RefChem:1058407?
The molecular formula of RefChem:1058407 is C19H21ClN4O2.
What is the molecular weight of RefChem:1058407?
The molecular weight of RefChem:1058407 is 372.1353 g/mol.
Where can I buy RefChem:1058407?
You can request a quote for RefChem:1058407 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1058407?
Yes, CoreyChem provides custom synthesis services for RefChem:1058407 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.