N-Acetylmescaline
TL;DR: N-Acetylmescaline (CAS 4593-89-9) is a chemical compound with molecular formula C13H19NO4 and molecular weight 253.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4,5-trimethoxyphenyl)ethyl]acetamide
Also Known As: N-Acetylmescaline, N-Acetyl Mescaline, Mescaline, N-acetyl-, Mescaline acetate, N-Acetyl Mescaline-d3
| Molecular Formula | C13H19NO4 |
|---|---|
| Molecular Weight | 253.13 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 56.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.13141 |
| Heavy Atoms | 18 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 4593-89-9 |
|---|---|
| SMILES | CC(=O)NCCC1=CC(=C(C(=C1)OC)OC)OC |
| InChIKey | SNMFNOQKGANWHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Acetylmescaline (CAS 4593-89-9), with molecular formula C13H19NO4 and molecular weight 253.13 g/mol. IUPAC: N-[2-(3,4,5-trimethoxyphenyl)ethyl]acetamide.
Chemical Property Profile of N-Acetylmescaline
Property Insights of N-Acetylmescaline
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Acetylmescaline. With a topological polar surface area (TPSA) of 56.8 Ų, N-Acetylmescaline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Acetylmescaline has 1 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 N-Acetylmescaline?
The CAS number of N-Acetylmescaline is 4593-89-9.
What is the molecular formula of N-Acetylmescaline?
The molecular formula of N-Acetylmescaline is C13H19NO4.
What is the molecular weight of N-Acetylmescaline?
The molecular weight of N-Acetylmescaline is 253.13 g/mol.
Where can I buy N-Acetylmescaline?
You can request a quote for N-Acetylmescaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetylmescaline?
Yes, KEHONG BIO provides custom synthesis services for N-Acetylmescaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.