Ici 130685
TL;DR: Ici 130685 (CAS 104443-76-7) is a chemical compound with molecular formula C11H17N and molecular weight 163.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(8S)-8-tetracyclo[4.3.0.02,4.03,7]nonanyl]ethanamine
Also Known As: ICI 130,685, alpha-Tetracyclo(3.3.1.0(2,9),0(4,8))nonanemethanamine, 1-[(8S)-8-Tetracyclo[4.3.0.02,4.03,7]nonanyl]ethanamine, 1-[Octahydro-1,2,4-(methanetriyl)pentalen-5-yl]ethan-1-amine, 1-[(5S)-Octahydro-1,2,4-(methanetriyl)pentalen-5-yl]ethan-1-amine
| Molecular Formula | C11H17N |
|---|---|
| Molecular Weight | 163.14 g/mol |
| LogP | 1.4816 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.1361 |
| Heavy Atoms | 12 |
| Complexity | 247.38867 |
Chemical Identifiers
| CAS Number | 104443-76-7 |
|---|---|
| SMILES | CC([C@H]1CC2C3C1C4C2C4C3)N |
Product Overview
Ici 130685 (CAS 104443-76-7), with molecular formula C11H17N and molecular weight 163.14 g/mol. IUPAC: 1-[(8S)-8-tetracyclo[4.3.0.02,4.03,7]nonanyl]ethanamine.
Chemical Property Profile of Ici 130685
Property Insights of Ici 130685
The XLogP value of 1.4816 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ici 130685. With a topological polar surface area (TPSA) of 26.02 Ų, Ici 130685 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ici 130685 has 1 hydrogen bond donor(s) and 1 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 Ici 130685?
The CAS number of Ici 130685 is 104443-76-7.
What is the molecular formula of Ici 130685?
The molecular formula of Ici 130685 is C11H17N.
What is the molecular weight of Ici 130685?
The molecular weight of Ici 130685 is 163.14 g/mol.
Where can I buy Ici 130685?
You can request a quote for Ici 130685 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 130685?
Yes, KEHONG BIO provides custom synthesis services for Ici 130685 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.