Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine
TL;DR: Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine (CAS 959-52-4) is a chemical compound with molecular formula C12H15N3O3 and molecular weight 249.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-di(prop-2-enoyl)-1,3,5-triazinan-1-yl]prop-2-en-1-one
Also Known As: Triacrylformal, Fixierer P, 1,3,5-Triacryloylhexahydro-1,3,5-triazine, Triacryloylperhydrotriazine, Triacryloylhexahydrotriazine
| Molecular Formula | C12H15N3O3 |
|---|---|
| Molecular Weight | 249.11 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.11134 |
| Heavy Atoms | 18 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 959-52-4 |
|---|---|
| SMILES | C=CC(=O)N1CN(CN(C1)C(=O)C=C)C(=O)C=C |
| InChIKey | FYBFGAFWCBMEDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine (CAS 959-52-4), with molecular formula C12H15N3O3 and molecular weight 249.11 g/mol. IUPAC: 1-[3,5-di(prop-2-enoyl)-1,3,5-triazinan-1-yl]prop-2-en-1-one.
Chemical Property Profile of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine
Property Insights of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine. Following Lipinski's Rule of Five, Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine has 0 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 Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine?
The CAS number of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine is 959-52-4.
What is the molecular formula of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine?
The molecular formula of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine is C12H15N3O3.
What is the molecular weight of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine?
The molecular weight of Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine is 249.11 g/mol.
Where can I buy Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine?
You can request a quote for Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for Hexahydro-1,3,5-tris(1-oxoallyl)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.