RefChem:318617
TL;DR: RefChem:318617 (CAS 35690-14-3) is a chemical compound with molecular formula C26H43Br2NO3 and molecular weight 575.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromo-4,5-diethoxyphenyl)methyl-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]-dimethylazanium bromide
Also Known As: Ammonium, ((2-bromo-4,5-diethoxy)benzyl)dimethyl(2-(2-(6,6-dimethyl-2-norpinyl)ethoxy)ethyl)-, bromide, (2-Bromo-4,5-diethoxyphenyl)methyl-[2-[2-(7,7-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]-dimethylazaniumbromide, AMMONIUM, ((2-BROMO-4,5-DIETHOXY)BENZYL)DIMETHYL(2-(2-(6,6-DIMETHYL-2-NORPINYL)E, (2-bromo-4,5-diethoxyphenyl)methyl-[2-[2-(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]-dimethylazanium bromide, Benzenemethanaminium, 2-bromo-N-[2-[2-(6,6-dimethylbicyclo[3.1.1]hept-2-yl)ethoxy]ethyl]-4,5-diethoxy-N,N-dimethyl-, bromide
| Molecular Formula | C26H43Br2NO3 |
|---|---|
| Molecular Weight | 575.16 g/mol |
| LogP | 3.31 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 577.15894 |
| Heavy Atoms | 32 |
| Complexity | 555.0 |
Chemical Identifiers
| CAS Number | 35690-14-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C(=C1)C[N+](C)(C)CCOCCC2CCC3CC2C3(C)C)Br)OCC.[Br-] |
| InChIKey | VGLITONBHLMDKO-UHFFFAOYSA-M |
Product Overview
RefChem:318617 (CAS 35690-14-3), with molecular formula C26H43Br2NO3 and molecular weight 575.16 g/mol. IUPAC: (2-bromo-4,5-diethoxyphenyl)methyl-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]-dimethylazanium bromide.
Chemical Property Profile of RefChem:318617
Property Insights of RefChem:318617
The XLogP value of 3.31 indicates that RefChem:318617 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.7 Ų, RefChem:318617 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318617 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:318617?
The CAS number of RefChem:318617 is 35690-14-3.
What is the molecular formula of RefChem:318617?
The molecular formula of RefChem:318617 is C26H43Br2NO3.
What is the molecular weight of RefChem:318617?
The molecular weight of RefChem:318617 is 575.16 g/mol.
Where can I buy RefChem:318617?
You can request a quote for RefChem:318617 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318617?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318617 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.