阿普洛尔
TL;DR: 阿普洛尔 (CAS 13655-52-2) is a chemical compound with molecular formula C15H23NO2 and molecular weight 249.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
阿普洛尔
1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol
Also Known As: alprenolol, Alpheprol, Alfeprol, Alprenololum, Yobir
| Molecular Formula | C15H23NO2 |
|---|---|
| Molecular Weight | 249.17 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 249.17288 |
| Heavy Atoms | 18 |
| Complexity | 231.0 |
| Melting Point | 107-109 °C |
| Solubility | 547 |
Chemical Identifiers
| CAS Number | 13655-52-2 |
|---|---|
| SMILES | CC(C)NCC(COC1=CC=CC=C1CC=C)O |
| InChIKey | PAZJSJFMUHDSTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
阿普洛尔 (CAS 13655-52-2), with molecular formula C15H23NO2 and molecular weight 249.17 g/mol. IUPAC: 1-(propan-2-ylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol.
Chemical Property Profile of 阿普洛尔
Property Insights of 阿普洛尔
The XLogP value of 3.1 indicates that 阿普洛尔 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.5 Ų, 阿普洛尔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 阿普洛尔 has 2 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 阿普洛尔?
The CAS number of 阿普洛尔 is 13655-52-2.
What is the molecular formula of 阿普洛尔?
The molecular formula of 阿普洛尔 is C15H23NO2.
What is the molecular weight of 阿普洛尔?
The molecular weight of 阿普洛尔 is 249.17 g/mol.
Where can I buy 阿普洛尔?
You can request a quote for 阿普洛尔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 阿普洛尔?
Yes, KEHONG BIO provides custom synthesis services for 阿普洛尔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.