1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride
TL;DR: 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride (CAS 132684-42-5) is a chemical compound with molecular formula C42H63Br3N6O3 and molecular weight 936.25116 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,3-dimethylphenyl)methyl-[2-[3-[2-[(2,5-dimethylphenyl)methyl-dimethylazaniumyl]ethyl]-5-[2-[(3,4-dimethylphenyl)methyl-dimethylazaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethylazanium tribromide
Also Known As: 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride, (2,3-dimethylphenyl)methyl-[2-[3-[2-[(2,5-dimethylphenyl)methyl-dimethylazaniumyl]ethyl]-5-[2-[(3,4-dimethylphenyl)methyl-dimethylazaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl]-dimethylazanium tribromide, N-[(3,4-Dimethylphenyl)methyl]-2-[3-(2-{[(2,3-dimethylphenyl)methyl](dimethyl)azaniumyl}ethyl)-5-(2-{[(2,5-dimethylphenyl)methyl](dimethyl)azaniumyl}ethyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-N,N-dimethylethan-1-aminium tribromide, N-[(3,4-Dimethylphenyl)methyl]-2-[3-(2-{[(2,3-dimethylphenyl)methyl]di(methyl)azaniumyl}ethyl)-5-(2-{[(2,5-dimethylphenyl)methyl]di(methyl)azaniumyl}ethyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-N,N-dimethylethan-1-aminium tribromide
Technical Specifications
| Molecular Formula | C42H63Br3N6O3 |
| Molecular Weight | 936.25116 g/mol |
| XLogP | -4.13598 |
| Topological Polar Surface Area (TPSA) | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 936.25116 Da |
| Heavy Atoms | 54 |
| Complexity | 1190.0 |
| SMILES | CC1=CC(=C(C=C1)C)C[N+](C)(C)CCN2C(=O)N(C(=O)N(C2=O)CC[N+](C)(C)CC3=CC=CC(=C3C)C)CC[N+](C)(C)CC4=CC(=C(C=C4)C)C.[Br-].[Br-].[Br-] |
| InChIKey | HTJGSPLJEIHBHH-UHFFFAOYSA-K |
Chemical Property Profile of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride
Property Insights of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride
The XLogP value of -4.13598 indicates that 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride. Following Lipinski's Rule of Five, 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride?
The CAS number of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride is 132684-42-5.
What is the molecular formula of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride?
The molecular formula of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride is C42H63Br3N6O3.
What is the molecular weight of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride?
The molecular weight of 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride is 936.25116 g/mol.
Where can I buy 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride?
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Does CoreyChem offer custom synthesis for 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride?
Yes, CoreyChem provides custom synthesis services for 1,3,5-Triazine-1,3,5(2H,4H,6H)-triethanaminium, N,N,N',N',N'',N''-hexamethyl-2,4,6-trioxo-N,N',N''-tris((2,4-dimethylphenyl)methyl)-, trichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.