Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)
TL;DR: Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) (CAS 4059-24-9) is a chemical compound with molecular formula C26H28ClNO5 and molecular weight 469.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[methyl(2-phenylethyl)amino]-1-phenylpropan-1-ol;oxalic acid
Also Known As: 4-Chloro-alpha-(2-(methylphenethylamino)ethyl)benzhydrol oxalate, 1-Propanol, 1-p-chlorophenyl-3-methylphenethylamino-1-phenyl-, oxalate, Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1), 1-(4-chlorophenyl)-3-[methyl(phenethyl)amino]-1-phenylpropan-1-ol; oxalic acid, Oxalic acid--1-(4-chlorophenyl)-3-[methyl(2-phenylethyl)amino]-1-phenylpropan-1-ol (1/1)
| Molecular Formula | C26H28ClNO5 |
|---|---|
| Molecular Weight | 469.17 g/mol |
| LogP | 4.2961 |
| Topological Polar Surface Area | 98.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 469.1656 |
| Heavy Atoms | 33 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 4059-24-9 |
|---|---|
| SMILES | CN(CCC1=CC=CC=C1)CCC(C2=CC=CC=C2)(C3=CC=C(C=C3)Cl)O.C(=O)(C(=O)O)O |
| InChIKey | SSBLWPSYDRBBRS-UHFFFAOYSA-N |
Product Overview
Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) (CAS 4059-24-9), with molecular formula C26H28ClNO5 and molecular weight 469.17 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[methyl(2-phenylethyl)amino]-1-phenylpropan-1-ol;oxalic acid.
Chemical Property Profile of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)
Property Insights of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)
The XLogP value of 4.2961 indicates that Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1). Following Lipinski's Rule of Five, Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) has 3 hydrogen bond donor(s) and 6 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 Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)?
The CAS number of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) is 4059-24-9.
What is the molecular formula of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)?
The molecular formula of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) is C26H28ClNO5.
What is the molecular weight of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)?
The molecular weight of Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) is 469.17 g/mol.
Where can I buy Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)?
You can request a quote for Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benzhydrol, 4-chloro-alpha-(2-(methylphenethylamino)ethyl)-, oxalate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.