RefChem:378164
TL;DR: RefChem:378164 (CAS 28478-49-1) is a chemical compound with molecular formula C16H24BrClN2O3 and molecular weight 406.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-N-[(1-ethyl-1-methylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-methoxybenzamide bromide
Also Known As: 2-( -1-ethyl-1-methylpyrrolidiniumbromide, 2-((5-Chloro-4-hydroxy-o-anisamido)methyl)-1-ethyl-1-methylpyrrolidinium bromide, N-(1-Ethyl-2-pyrrolidylmethyl)-2-methoxy-4-hydroxy-5-chlorobenzamide bromomethylate, Pyrrolidinium, 2-((5-chloro-4-hydroxy-o-anisamido)methyl)-1-ethyl-1-methyl-, bromide, 5-chloro-N-[(1-ethyl-1-methylpyrrolidin-1-ium-2-yl)methyl]-4
| Molecular Formula | C16H24BrClN2O3 |
|---|---|
| Molecular Weight | 406.07 g/mol |
| LogP | -0.5831 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.0659 |
| Heavy Atoms | 23 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 28478-49-1 |
|---|---|
| SMILES | CC[N+]1(CCCC1CNC(=O)C2=CC(=C(C=C2OC)O)Cl)C.[Br-] |
| InChIKey | ZSFNTERQOJPYJW-UHFFFAOYSA-N |
Product Overview
RefChem:378164 (CAS 28478-49-1), with molecular formula C16H24BrClN2O3 and molecular weight 406.07 g/mol. IUPAC: 5-chloro-N-[(1-ethyl-1-methylpyrrolidin-1-ium-2-yl)methyl]-4-hydroxy-2-methoxybenzamide bromide.
Chemical Property Profile of RefChem:378164
Property Insights of RefChem:378164
The XLogP value of -0.5831 indicates that RefChem:378164 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.6 Ų, RefChem:378164 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:378164 has 2 hydrogen bond donor(s) and 4 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 RefChem:378164?
The CAS number of RefChem:378164 is 28478-49-1.
What is the molecular formula of RefChem:378164?
The molecular formula of RefChem:378164 is C16H24BrClN2O3.
What is the molecular weight of RefChem:378164?
The molecular weight of RefChem:378164 is 406.07 g/mol.
Where can I buy RefChem:378164?
You can request a quote for RefChem:378164 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:378164?
Yes, KEHONG BIO provides custom synthesis services for RefChem:378164 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.