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((3-methylphenyl)methyl)-, tribromide
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((3-methylphenyl)methyl)-, tribromide (CAS 132684-41-4) is a chemical compound with molecular formula C39H57Br3N6O3 and molecular weight 894.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3,5-bis[2-[dimethyl-[(2-methylphenyl)methyl]azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-methylphenyl)methyl]azanium 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((3-methylphenyl)methyl)-, tribromide, 2,2'-[5-(2-{Dimethyl[(3-methylphenyl)methyl]azaniumyl}ethyl)-2,4,6-trioxo-1,3,5-triazinane-1,3-diyl]bis{N,N-dimethyl-N-[(2-methylphenyl)methyl]ethan-1-aminium} tribromide, 2-[3,5-bis[2-[dimethyl-[(2-methylphenyl)methyl]azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-methylphenyl)methyl]azanium tribromide, RefChem:217327
| Molecular Formula | C39H57Br3N6O3 |
|---|---|
| Molecular Weight | 894.20 g/mol |
| LogP | -5.06124 |
| Topological Polar Surface Area | 66.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 894.2042 |
| Heavy Atoms | 51 |
| Complexity | 1811.5823 |
Chemical Identifiers
| CAS Number | 132684-41-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C[N+](C)(C)CCN2C(=O)N(C(=O)N(C2=O)CC[N+](C)(C)CC3=CC=CC=C3C)CC[N+](C)(C)CC4=CC=CC=C4C.[Br-].[Br-].[Br-] |
Product Overview
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((3-methylphenyl)methyl)-, tribromide (CAS 132684-41-4), with molecular formula C39H57Br3N6O3 and molecular weight 894.20 g/mol. IUPAC: 2-[3,5-bis[2-[dimethyl-[(2-methylphenyl)methyl]azaniumyl]ethyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]ethyl-dimethyl-[(3-methylphenyl)methyl]azanium tribromide.
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((3-methylphenyl)methyl)-, tribromide
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((3-methylphenyl)methyl)-, tribromide
The XLogP value of -5.06124 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((3-methylphenyl)methyl)-, tribromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.0 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((3-methylphenyl)methyl)-, tribromide. 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((3-methylphenyl)methyl)-, tribromide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
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((3-methylphenyl)methyl)-, tribromide?
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((3-methylphenyl)methyl)-, tribromide is 132684-41-4.
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((3-methylphenyl)methyl)-, tribromide?
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((3-methylphenyl)methyl)-, tribromide is C39H57Br3N6O3.
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((3-methylphenyl)methyl)-, tribromide?
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((3-methylphenyl)methyl)-, tribromide is 894.20 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((3-methylphenyl)methyl)-, tribromide?
You can request a quote 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((3-methylphenyl)methyl)-, tribromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO 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((3-methylphenyl)methyl)-, tribromide?
Yes, KEHONG BIO 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((3-methylphenyl)methyl)-, tribromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.