RefChem:232210
TL;DR: RefChem:232210 (CAS 5834-58-2) is a chemical compound with molecular formula C20H28ClNO2 and molecular weight 349.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-carboxy-4-methyl-3-naphthalen-1-ylpentyl)-ethyl-methylazanium chloride
Also Known As: alpha-Isopropyl-alpha-2-methylethylaminoethyl-1-naphthylacetic acid hydrochloride, 1-Naphthaleneacetic acid, alpha-(2-(ethylmethylamino)ethyl)-alpha-isopropyl-, hydrochloride, alpha-(2-(Ethylmethylamino)ethyl)-alpha-isopropyl-1-naphthaleneacetic acid hydrochloride, (3-carboxy-4-methyl-3-naphthalen-1-ylpentyl)-ethyl-methylazanium chloride, RefChem:232210
| Molecular Formula | C20H28ClNO2 |
|---|---|
| Molecular Weight | 349.18 g/mol |
| LogP | -0.25 |
| Topological Polar Surface Area | 41.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 349.18085 |
| Heavy Atoms | 24 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 5834-58-2 |
|---|---|
| SMILES | CC[NH+](C)CCC(C1=CC=CC2=CC=CC=C21)(C(C)C)C(=O)O.[Cl-] |
| InChIKey | HVGFPYHJEIWTRN-UHFFFAOYSA-N |
Product Overview
RefChem:232210 (CAS 5834-58-2), with molecular formula C20H28ClNO2 and molecular weight 349.18 g/mol. IUPAC: (3-carboxy-4-methyl-3-naphthalen-1-ylpentyl)-ethyl-methylazanium chloride.
Chemical Property Profile of RefChem:232210
Property Insights of RefChem:232210
The XLogP value of -0.25 indicates that RefChem:232210 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.7 Ų, RefChem:232210 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:232210 has 2 hydrogen bond donor(s) and 3 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:232210?
The CAS number of RefChem:232210 is 5834-58-2.
What is the molecular formula of RefChem:232210?
The molecular formula of RefChem:232210 is C20H28ClNO2.
What is the molecular weight of RefChem:232210?
The molecular weight of RefChem:232210 is 349.18 g/mol.
Where can I buy RefChem:232210?
You can request a quote for RefChem:232210 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:232210?
Yes, KEHONG BIO provides custom synthesis services for RefChem:232210 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.