Trilostane
TL;DR: Trilostane (CAS 13647-35-3) is a chemical compound with molecular formula C20H27NO3 and molecular weight 329.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-hydroxy-2,16-dimethyl-5-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadecane-4-carbonitrile
Also Known As: Trilostane, Modrastane, Modrefen, Modrenal, Trilostanum [INN-Latin]
| Molecular Formula | C20H27NO3 |
|---|---|
| Molecular Weight | 329.20 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 73.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.1991 |
| Heavy Atoms | 24 |
| Complexity | 667.0 |
Chemical Identifiers
| CAS Number | 13647-35-3 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2O)CCC45C3(CC(C(=O)C4O5)C#N)C |
| InChIKey | RLQVKDVIBJCQGE-UHFFFAOYSA-N |
Product Overview
Trilostane (CAS 13647-35-3), with molecular formula C20H27NO3 and molecular weight 329.20 g/mol. IUPAC: 15-hydroxy-2,16-dimethyl-5-oxo-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadecane-4-carbonitrile.
Chemical Property Profile of Trilostane
Property Insights of Trilostane
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trilostane. The TPSA of 73.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Trilostane. Following Lipinski's Rule of Five, Trilostane 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 Trilostane?
The CAS number of Trilostane is 13647-35-3.
What is the molecular formula of Trilostane?
The molecular formula of Trilostane is C20H27NO3.
What is the molecular weight of Trilostane?
The molecular weight of Trilostane is 329.20 g/mol.
Where can I buy Trilostane?
You can request a quote for Trilostane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trilostane?
Yes, KEHONG BIO provides custom synthesis services for Trilostane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.