hexazinone TP3
TL;DR: hexazinone TP3 (CAS 72585-88-7) is a chemical compound with molecular formula C11H18N4O3 and molecular weight 254.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hydroxycyclohexyl)-1-methyl-6-(methylamino)-1,3,5-triazine-2,4-dione
Also Known As: hexazinone TP3, Hexazinon metabolite, Hexazinone metabolite C, Lead bis(nonylphenolate), rel-trans-N-Desmethyl 4-Hydroxy Hexazinone
| Molecular Formula | C11H18N4O3 |
|---|---|
| Molecular Weight | 254.14 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 85.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.1379 |
| Heavy Atoms | 18 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 72585-88-7 |
|---|---|
| SMILES | CNC1=NC(=O)N(C(=O)N1C)C2CCC(CC2)O |
| InChIKey | YLNFKJPRYUIXTG-UHFFFAOYSA-N |
Product Overview
hexazinone TP3 (CAS 72585-88-7), with molecular formula C11H18N4O3 and molecular weight 254.14 g/mol. IUPAC: 3-(4-hydroxycyclohexyl)-1-methyl-6-(methylamino)-1,3,5-triazine-2,4-dione.
Chemical Property Profile of hexazinone TP3
Property Insights of hexazinone TP3
The XLogP value of -0.1 indicates that hexazinone TP3 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for hexazinone TP3. Following Lipinski's Rule of Five, hexazinone TP3 has 2 hydrogen bond donor(s) and 3 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 hexazinone TP3?
The CAS number of hexazinone TP3 is 72585-88-7.
What is the molecular formula of hexazinone TP3?
The molecular formula of hexazinone TP3 is C11H18N4O3.
What is the molecular weight of hexazinone TP3?
The molecular weight of hexazinone TP3 is 254.14 g/mol.
Where can I buy hexazinone TP3?
You can request a quote for hexazinone TP3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hexazinone TP3?
Yes, KEHONG BIO provides custom synthesis services for hexazinone TP3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.