Phenethylamine, alpha-methyl- and scopolamine (20:1)
TL;DR: Phenethylamine, alpha-methyl- and scopolamine (20:1) (CAS 74203-44-4) is a chemical compound with molecular formula C26H34N2O4 and molecular weight 438.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-3-hydroxy-2-phenylpropanoate;1-phenylpropan-2-amine
Also Known As: Phenethylamine, alpha-methyl- and scopolamine (20:1), 9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-7-yl 3-hydroxy-2-phenylpropanoate--1-phenylpropan-2-amine (1/1), (1R,5S)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-7-yl (2S)-3-hydroxy-2-phenylpropanoate--1-phenylpropan-2-amine (1/1)
| Molecular Formula | C26H34N2O4 |
|---|---|
| Molecular Weight | 438.25 g/mol |
| LogP | 2.4944 |
| Topological Polar Surface Area | 88.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.25186 |
| Heavy Atoms | 32 |
| Complexity | 857.91034 |
Chemical Identifiers
| CAS Number | 74203-44-4 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)N.CN1[C@@H]2CC(C[C@H]1C3C2O3)OC(=O)[C@H](CO)C4=CC=CC=C4 |
Product Overview
Phenethylamine, alpha-methyl- and scopolamine (20:1) (CAS 74203-44-4), with molecular formula C26H34N2O4 and molecular weight 438.25 g/mol. IUPAC: [(1R,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-3-hydroxy-2-phenylpropanoate;1-phenylpropan-2-amine.
Chemical Property Profile of Phenethylamine, alpha-methyl- and scopolamine (20:1)
Property Insights of Phenethylamine, alpha-methyl- and scopolamine (20:1)
The XLogP value of 2.4944 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenethylamine, alpha-methyl- and scopolamine (20:1). The TPSA of 88.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenethylamine, alpha-methyl- and scopolamine (20:1). Following Lipinski's Rule of Five, Phenethylamine, alpha-methyl- and scopolamine (20:1) has 2 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 Phenethylamine, alpha-methyl- and scopolamine (20:1)?
The CAS number of Phenethylamine, alpha-methyl- and scopolamine (20:1) is 74203-44-4.
What is the molecular formula of Phenethylamine, alpha-methyl- and scopolamine (20:1)?
The molecular formula of Phenethylamine, alpha-methyl- and scopolamine (20:1) is C26H34N2O4.
What is the molecular weight of Phenethylamine, alpha-methyl- and scopolamine (20:1)?
The molecular weight of Phenethylamine, alpha-methyl- and scopolamine (20:1) is 438.25 g/mol.
Where can I buy Phenethylamine, alpha-methyl- and scopolamine (20:1)?
You can request a quote for Phenethylamine, alpha-methyl- and scopolamine (20:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenethylamine, alpha-methyl- and scopolamine (20:1)?
Yes, KEHONG BIO provides custom synthesis services for Phenethylamine, alpha-methyl- and scopolamine (20:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.