溴芐胺
TL;DR: 溴芐胺 (CAS 59-41-6) is a chemical compound with molecular formula C11H17BrN+ and molecular weight 242.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴芐胺
(2-bromophenyl)methyl-ethyl-dimethylazanium
Also Known As: Bretylium, Bretylum, Bretylium tosylate, Bretylate, Bretylan
| Molecular Formula | C11H17BrN+ |
|---|---|
| Molecular Weight | 242.05 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.05444 |
| Heavy Atoms | 13 |
| Complexity | 156.0 |
| Melting Point | 238 |
| Solubility | Freely soluble |
Chemical Identifiers
| CAS Number | 59-41-6 |
|---|---|
| SMILES | CC[N+](C)(C)CC1=CC=CC=C1Br |
| InChIKey | AAQOQKQBGPPFNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溴芐胺 (CAS 59-41-6), with molecular formula C11H17BrN+ and molecular weight 242.05 g/mol. IUPAC: (2-bromophenyl)methyl-ethyl-dimethylazanium.
Chemical Property Profile of 溴芐胺
Property Insights of 溴芐胺
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 溴芐胺. With a topological polar surface area (TPSA) of 0.0 Ų, 溴芐胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 溴芐胺 has 0 hydrogen bond donor(s) and 0 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 溴芐胺?
The CAS number of 溴芐胺 is 59-41-6.
What is the molecular formula of 溴芐胺?
The molecular formula of 溴芐胺 is C11H17BrN+.
What is the molecular weight of 溴芐胺?
The molecular weight of 溴芐胺 is 242.05 g/mol.
Where can I buy 溴芐胺?
You can request a quote for 溴芐胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴芐胺?
Yes, KEHONG BIO provides custom synthesis services for 溴芐胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.