RefChem:319382
TL;DR: RefChem:319382 (CAS 72017-48-2) is a chemical compound with molecular formula C38H78Br2N2 and molecular weight 720.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[dimethyl-[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]azanium dibromide
Also Known As: Ammonium, hexamethylenebis(1-methyl-3-(2,2,3,6-tetramethylcyclohexyl)propyl)bis(dimethyl-, dibromide, hydrate, 6-[dimethyl-[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]azanium dibromide, AMMONIUM, HEXAMETHYLENEBIS(1-METHYL-3-(2,2,3,6-TETRAMETHYLCYCLOHEXYL)PROPYL)BIS(, 1,6-Hexanediaminium, N,N,N',N'-tetramethyl-N,N'-bis[1-methyl-3-(2,2,3,6-tetramethylcyclohexyl)propyl]-, dibromide, monohydrate, N~1~,N~1~,N~6~,N~6~-Tetramethyl-N~1~,N~6~-bis[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]hexane-1,6-bis(aminium) dibromide
| Molecular Formula | C38H78Br2N2 |
|---|---|
| Molecular Weight | 720.45 g/mol |
| LogP | 4.46 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 722.4511 |
| Heavy Atoms | 42 |
| Complexity | 672.0 |
Chemical Identifiers
| CAS Number | 72017-48-2 |
|---|---|
| SMILES | CC1CCC(C(C1CCC(C)[N+](C)(C)CCCCCC[N+](C)(C)C(C)CCC2C(CCC(C2(C)C)C)C)(C)C)C.[Br-].[Br-] |
| InChIKey | WYWZHFCFTWHYHN-UHFFFAOYSA-L |
Product Overview
RefChem:319382 (CAS 72017-48-2), with molecular formula C38H78Br2N2 and molecular weight 720.45 g/mol. IUPAC: 6-[dimethyl-[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(2,2,3,6-tetramethylcyclohexyl)butan-2-yl]azanium dibromide.
Chemical Property Profile of RefChem:319382
Property Insights of RefChem:319382
The XLogP value of 4.46 indicates that RefChem:319382 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, RefChem:319382 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319382 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:319382?
The CAS number of RefChem:319382 is 72017-48-2.
What is the molecular formula of RefChem:319382?
The molecular formula of RefChem:319382 is C38H78Br2N2.
What is the molecular weight of RefChem:319382?
The molecular weight of RefChem:319382 is 720.45 g/mol.
Where can I buy RefChem:319382?
You can request a quote for RefChem:319382 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:319382?
Yes, KEHONG BIO provides custom synthesis services for RefChem:319382 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.