cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine
TL;DR: cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine (CAS 64265-21-0) is a chemical compound with molecular formula C5H8N2O5 and molecular weight 176.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-hydroperoxy-5-hydroxy-5-methyl-1,3-diazinane-2,4-dione
Also Known As: 6-Tooh, cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine, 5-hydroxy-6-hydroperoxy-dihydrothymine, cis-6-Hydroperoxy-5-hydroxy-5-methylhydrouracil, 5-25-03-00256 (Beilstein Handbook Reference)
| Molecular Formula | C5H8N2O5 |
|---|---|
| Molecular Weight | 176.04 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.04332 |
| Heavy Atoms | 12 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 64265-21-0 |
|---|---|
| SMILES | CC1(C(NC(=O)NC1=O)OO)O |
| InChIKey | GQCPWBQRXKVGES-UHFFFAOYSA-N |
Product Overview
cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine (CAS 64265-21-0), with molecular formula C5H8N2O5 and molecular weight 176.04 g/mol. IUPAC: 6-hydroperoxy-5-hydroxy-5-methyl-1,3-diazinane-2,4-dione.
Chemical Property Profile of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine
Property Insights of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine
The XLogP value of -1.4 indicates that cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine. Following Lipinski's Rule of Five, cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine has 4 hydrogen bond donor(s) and 5 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 cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine?
The CAS number of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine is 64265-21-0.
What is the molecular formula of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine?
The molecular formula of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine is C5H8N2O5.
What is the molecular weight of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine?
The molecular weight of cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine is 176.04 g/mol.
Where can I buy cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine?
You can request a quote for cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine?
Yes, KEHONG BIO provides custom synthesis services for cis-5,6-Dihydro-6-hydroperoxy-5-hydroxythymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.