尼索西汀
TL;DR: 尼索西汀 (CAS 53179-07-0) is a chemical compound with molecular formula C17H21NO2 and molecular weight 271.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
尼索西汀
3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine
Also Known As: Nisoxetine, Nisoxetina, Nisoxetinum, Compound 89218, Nisoxetine HCl
| Molecular Formula | C17H21NO2 |
|---|---|
| Molecular Weight | 271.16 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 30.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 271.15723 |
| Heavy Atoms | 20 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 53179-07-0 |
|---|---|
| SMILES | CNCCC(C1=CC=CC=C1)OC2=CC=CC=C2OC |
| InChIKey | ITJNARMNRKSWTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
尼索西汀 (CAS 53179-07-0), with molecular formula C17H21NO2 and molecular weight 271.16 g/mol. IUPAC: 3-(2-methoxyphenoxy)-N-methyl-3-phenylpropan-1-amine.
Chemical Property Profile of 尼索西汀
Property Insights of 尼索西汀
The XLogP value of 3.1 indicates that 尼索西汀 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.5 Ų, 尼索西汀 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 尼索西汀 has 1 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 尼索西汀?
The CAS number of 尼索西汀 is 53179-07-0.
What is the molecular formula of 尼索西汀?
The molecular formula of 尼索西汀 is C17H21NO2.
What is the molecular weight of 尼索西汀?
The molecular weight of 尼索西汀 is 271.16 g/mol.
Where can I buy 尼索西汀?
You can request a quote for 尼索西汀 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 尼索西汀?
Yes, KEHONG BIO provides custom synthesis services for 尼索西汀 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.