BAS 06503031
TL;DR: BAS 06503031 (CAS 105522-57-4) is a chemical compound with molecular formula C16H19N5O4 and molecular weight 345.1437 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(2-hydroxyethylamino)-3-methyl-7-(2-phenoxyethyl)purine-2,6-dione
Also Known As: BAS 06503031, 7-(2-Phenoxyethyl)-8-((2-hydroxyethyl)amino)-3-methylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-8-((2-hydroxyethyl)amino)-3-methyl-7-(2-phenoxyethyl)-, 3,7-Dihydro-8-((2-hydroxyethyl)amino)-3-methyl-7-(2-phenoxyethyl)-1H-purine-2,6-dione, AB00821104-06
Technical Specifications
| Molecular Formula | C16H19N5O4 |
| Molecular Weight | 345.1437 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.1437 Da |
| Heavy Atoms | 25 |
| Complexity | 485.0 |
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCO)CCOC3=CC=CC=C3 |
| InChIKey | SMCLVHVZVVGNSQ-UHFFFAOYSA-N |
Chemical Property Profile of BAS 06503031
Property Insights of BAS 06503031
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06503031. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06503031. Following Lipinski's Rule of Five, BAS 06503031 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of BAS 06503031?
The CAS number of BAS 06503031 is 105522-57-4.
What is the molecular formula of BAS 06503031?
The molecular formula of BAS 06503031 is C16H19N5O4.
What is the molecular weight of BAS 06503031?
The molecular weight of BAS 06503031 is 345.1437 g/mol.
Where can I buy BAS 06503031?
You can request a quote for BAS 06503031 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for BAS 06503031?
Yes, CoreyChem provides custom synthesis services for BAS 06503031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.