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14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one
TL;DR: 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one (CAS 22502-48-3) is a chemical compound with molecular formula C14H20OS and molecular weight 236.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-sulfanylidenedispiro[5.1.58.16]tetradecan-7-one
Also Known As: 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one, 14-sulfanylidenedispiro[5.1.58.16]tetradecan-7-one, 14-oxodispiro<5.1.5.1>tetradecane-7-thione, Dispiro[5.1.5.1]tetradecan-7-one,14-thioxo-, 14-Sulfanylidenedispiro[5.1.5~8~.1~6~]tetradecan-7-one
| Molecular Formula | C14H20OS |
|---|---|
| Molecular Weight | 236.12 g/mol |
| LogP | 3.84 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.12349 |
| Heavy Atoms | 16 |
| Complexity | 282.6445 |
Chemical Identifiers
| CAS Number | 22502-48-3 |
|---|---|
| SMILES | C1CCC2(CC1)C(=O)C3(C2=S)CCCCC3 |
Product Overview
14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one (CAS 22502-48-3), with molecular formula C14H20OS and molecular weight 236.12 g/mol. IUPAC: 14-sulfanylidenedispiro[5.1.58.16]tetradecan-7-one.
Chemical Property Profile of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one
Property Insights of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one
The XLogP value of 3.84 indicates that 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one has 0 hydrogen bond donor(s) and 2 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 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one?
The CAS number of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one is 22502-48-3.
What is the molecular formula of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one?
The molecular formula of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one is C14H20OS.
What is the molecular weight of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one?
The molecular weight of 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one is 236.12 g/mol.
Where can I buy 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one?
You can request a quote for 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one?
Yes, KEHONG BIO provides custom synthesis services for 14-Thioxo-dispiro[5.1.5.1]tetradecan-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.