Cardiopetaline
TL;DR: Cardiopetaline (CAS 75375-43-8) is a chemical compound with molecular formula C21H33NO3 and molecular weight 347.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,8S,10S,13R,17R)-11-ethyl-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
Also Known As: Cardiopetaline, NCI60_019647, (13xi,17S)-20-Ethyl-4-methylaconitane-1,8,14-triol
| Molecular Formula | C21H33NO3 |
|---|---|
| Molecular Weight | 347.25 g/mol |
| LogP | 1.6257 |
| Topological Polar Surface Area | 63.93 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 347.24603 |
| Heavy Atoms | 25 |
| Complexity | 626.2624 |
Chemical Identifiers
| CAS Number | 75375-43-8 |
|---|---|
| SMILES | CCN1C[C@@]2(CCC(C34[C@@H]2CC([C@@H]31)[C@]5(CCC6C[C@@H]4[C@@H]5C6O)O)O)C |
Product Overview
Cardiopetaline (CAS 75375-43-8), with molecular formula C21H33NO3 and molecular weight 347.25 g/mol. IUPAC: (2R,3R,8S,10S,13R,17R)-11-ethyl-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol.
Chemical Property Profile of Cardiopetaline
Property Insights of Cardiopetaline
The XLogP value of 1.6257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cardiopetaline. The TPSA of 63.93 Ų falls within the moderate polarity range, balancing permeability and solubility for Cardiopetaline. Following Lipinski's Rule of Five, Cardiopetaline has 3 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 Cardiopetaline?
The CAS number of Cardiopetaline is 75375-43-8.
What is the molecular formula of Cardiopetaline?
The molecular formula of Cardiopetaline is C21H33NO3.
What is the molecular weight of Cardiopetaline?
The molecular weight of Cardiopetaline is 347.25 g/mol.
Where can I buy Cardiopetaline?
You can request a quote for Cardiopetaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cardiopetaline?
Yes, KEHONG BIO provides custom synthesis services for Cardiopetaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.