2,4-Dioxohexahydro-1,3,5-triazine
TL;DR: 2,4-Dioxohexahydro-1,3,5-triazine (CAS 27032-78-6) is a chemical compound with molecular formula C3H5N3O2 and molecular weight 115.03818 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,5-triazinane-2,4-dione
Also Known As: 1,3,5-triazinane-2,4-dione, Dioxohexahydrotriazine, 5-Azadihydrouracil, 2,4-dioxohexahydro-1,3,5-triazine, 5-AZAURACIL
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H5N3O2 |
| Molecular Weight | 115.03818 g/mol |
| XLogP | -1.2 |
| Topological Polar Surface Area (TPSA) | 70.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 115.03818 Da |
| Heavy Atoms | 8 |
| Complexity | 118.0 |
| SMILES | C1NC(=O)NC(=O)N1 |
| InChIKey | YTFXKURWTLWPKK-UHFFFAOYSA-N |
Chemical Property Profile of 2,4-Dioxohexahydro-1,3,5-triazine
Property Insights of 2,4-Dioxohexahydro-1,3,5-triazine
The XLogP value of -1.2 indicates that 2,4-Dioxohexahydro-1,3,5-triazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dioxohexahydro-1,3,5-triazine. Following Lipinski's Rule of Five, 2,4-Dioxohexahydro-1,3,5-triazine has 3 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,4-Dioxohexahydro-1,3,5-triazine?
The CAS number of 2,4-Dioxohexahydro-1,3,5-triazine is 27032-78-6.
What is the molecular formula of 2,4-Dioxohexahydro-1,3,5-triazine?
The molecular formula of 2,4-Dioxohexahydro-1,3,5-triazine is C3H5N3O2.
What is the molecular weight of 2,4-Dioxohexahydro-1,3,5-triazine?
The molecular weight of 2,4-Dioxohexahydro-1,3,5-triazine is 115.03818 g/mol.
Where can I buy 2,4-Dioxohexahydro-1,3,5-triazine?
You can request a quote for 2,4-Dioxohexahydro-1,3,5-triazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dioxohexahydro-1,3,5-triazine?
Yes, CoreyChem provides custom synthesis services for 2,4-Dioxohexahydro-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.