methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride
TL;DR: methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride (CAS 1050556-24-5) is a chemical compound with molecular formula C21H22ClNO4 and molecular weight 387.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[5-[[(2-hydroxy-2-phenylethyl)amino]methyl]furan-2-yl]benzoate;hydrochloride
Also Known As: methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride, methyl 4-[5-[[(2-hydroxy-2-phenylethyl)amino]methyl]furan-2-yl]benzoate hydrochloride
| Molecular Formula | C21H22ClNO4 |
|---|---|
| Molecular Weight | 387.12 g/mol |
| LogP | 3.9782 |
| Topological Polar Surface Area | 71.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.12375 |
| Heavy Atoms | 27 |
| Complexity | 846.1329 |
Chemical Identifiers
| CAS Number | 1050556-24-5 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)CNCC(C3=CC=CC=C3)O.Cl |
Product Overview
methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride (CAS 1050556-24-5), with molecular formula C21H22ClNO4 and molecular weight 387.12 g/mol. IUPAC: methyl 4-[5-[[(2-hydroxy-2-phenylethyl)amino]methyl]furan-2-yl]benzoate;hydrochloride.
Chemical Property Profile of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride
Property Insights of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride
The XLogP value of 3.9782 indicates that methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride. Following Lipinski's Rule of Five, methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride has 2 hydrogen bond donor(s) and 5 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 methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride?
The CAS number of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride is 1050556-24-5.
What is the molecular formula of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride?
The molecular formula of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride is C21H22ClNO4.
What is the molecular weight of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride?
The molecular weight of methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride is 387.12 g/mol.
Where can I buy methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride?
You can request a quote for methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-(5-(((2-hydroxy-2-phenylethyl)amino)methyl)furan-2-yl)benzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.