Levonantradol
TL;DR: Levonantradol (CAS 72028-54-7) is a chemical compound with molecular formula C27H35NO4 and molecular weight 437.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-hydroxy-6-methyl-3-(5-phenylpentan-2-yloxy)-5,6,6a,7,8,9,10,10a-octahydrophenanthridin-1-yl] acetate
Also Known As: Levonantradol, Nantradol, Nantrodolum, d-Nantradol, l-Nantradol
| Molecular Formula | C27H35NO4 |
|---|---|
| Molecular Weight | 437.26 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 437.25662 |
| Heavy Atoms | 32 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 72028-54-7 |
|---|---|
| SMILES | CC1C2CCC(CC2C3=C(N1)C=C(C=C3OC(=O)C)OC(C)CCCC4=CC=CC=C4)O |
| InChIKey | FFVXQGMUHIJQAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Levonantradol (CAS 72028-54-7), with molecular formula C27H35NO4 and molecular weight 437.26 g/mol. IUPAC: [9-hydroxy-6-methyl-3-(5-phenylpentan-2-yloxy)-5,6,6a,7,8,9,10,10a-octahydrophenanthridin-1-yl] acetate.
Chemical Property Profile of Levonantradol
Property Insights of Levonantradol
The XLogP value of 5.5 indicates that Levonantradol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Levonantradol. Following Lipinski's Rule of Five, Levonantradol has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Levonantradol?
The CAS number of Levonantradol is 72028-54-7.
What is the molecular formula of Levonantradol?
The molecular formula of Levonantradol is C27H35NO4.
What is the molecular weight of Levonantradol?
The molecular weight of Levonantradol is 437.26 g/mol.
Where can I buy Levonantradol?
You can request a quote for Levonantradol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Levonantradol?
Yes, KEHONG BIO provides custom synthesis services for Levonantradol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.