5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione
TL;DR: 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione (CAS 30265-59-9) is a chemical compound with molecular formula C6H9N3O3 and molecular weight 171.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Also Known As: Doxofylline Impurity 37, Thiazole, monohydrochloride, NCIOpen2_002105, 5-amino-1,3-dimethylbarbituric acid, 5-amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione
| Molecular Formula | C6H9N3O3 |
|---|---|
| Molecular Weight | 171.06 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 83.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 171.06439 |
| Heavy Atoms | 12 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 30265-59-9 |
|---|---|
| SMILES | CN1C(=O)C(C(=O)N(C1=O)C)N |
| InChIKey | COUUESOYZDECCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione (CAS 30265-59-9), with molecular formula C6H9N3O3 and molecular weight 171.06 g/mol. IUPAC: 5-amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione
Property Insights of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione
The XLogP value of -1.6 indicates that 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione has 1 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 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The CAS number of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione is 30265-59-9.
What is the molecular formula of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular formula of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione is C6H9N3O3.
What is the molecular weight of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
The molecular weight of 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione is 171.06 g/mol.
Where can I buy 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
You can request a quote for 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-1,3-dimethyl-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.