8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione
TL;DR: 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione (CAS 101072-16-6) is a chemical compound with molecular formula C9H11BrN4O3 and molecular weight 302.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione
Also Known As: 8-bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione, BAS 00162587, 8-bromo-7-(2-hydroxypropyl)-3-methyl-1H-purine-2,6(3H,7H)-dione, 8-bromo-7-(2-hydroxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione, F0373-0022
| Molecular Formula | C9H11BrN4O3 |
|---|---|
| Molecular Weight | 302.00 g/mol |
| LogP | -0.4334 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.00146 |
| Heavy Atoms | 17 |
| Complexity | 681.8314 |
Chemical Identifiers
| CAS Number | 101072-16-6 |
|---|---|
| SMILES | CC(CN1C2=C(N=C1Br)N(C(=O)NC2=O)C)O |
Product Overview
8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione (CAS 101072-16-6), with molecular formula C9H11BrN4O3 and molecular weight 302.00 g/mol. IUPAC: 8-bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione.
Chemical Property Profile of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione
Property Insights of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione
The XLogP value of -0.4334 indicates that 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione. Following Lipinski's Rule of Five, 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione has 2 hydrogen bond donor(s) and 4 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-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione?
The CAS number of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione is 101072-16-6.
What is the molecular formula of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione?
The molecular formula of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione is C9H11BrN4O3.
What is the molecular weight of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione?
The molecular weight of 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione is 302.00 g/mol.
Where can I buy 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione?
You can request a quote for 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-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-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromo-7-(2-hydroxypropyl)-3-methylpurine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.