8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione
TL;DR: 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione (CAS 536718-99-7) is a chemical compound with molecular formula C17H22N6O4 and molecular weight 374.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione
Also Known As: 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione, 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione, 8-((2-aminoethyl)amino)-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-[(2-aminoethyl)amino]-6-hydroxy-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-2H-purin-2-one, 8-[(2-aminoethyl)amino]-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C17H22N6O4 |
|---|---|
| Molecular Weight | 374.17 g/mol |
| LogP | -0.7662 |
| Topological Polar Surface Area | 140.19 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 374.17026 |
| Heavy Atoms | 27 |
| Complexity | 1023.56506 |
Chemical Identifiers
| CAS Number | 536718-99-7 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)NCCN)CC(COC3=CC=CC=C3)O |
Product Overview
8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione (CAS 536718-99-7), with molecular formula C17H22N6O4 and molecular weight 374.17 g/mol. IUPAC: 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxypropyl)-3-methylpurine-2,6-dione.
Chemical Property Profile of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione
Property Insights of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione
The XLogP value of -0.7662 indicates that 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.19 Ų indicates high polarity, suggesting 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione has 4 hydrogen bond donor(s) and 7 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 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione?
The CAS number of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione is 536718-99-7.
What is the molecular formula of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione?
The molecular formula of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione is C17H22N6O4.
What is the molecular weight of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione?
The molecular weight of 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione is 374.17 g/mol.
Where can I buy 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione?
You can request a quote for 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-(2-aminoethylamino)-7-(2-hydroxy-3-phenoxy-propyl)-3-methyl-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.