硫代葑酮
TL;DR: 硫代葑酮 (CAS 875-06-9) is a chemical compound with molecular formula C10H16S and molecular weight 168.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫代葑酮
1,3,3-trimethylbicyclo[2.2.1]heptane-2-thione
Also Known As: Thiofenchone, Fenchthione, Thiogenchone, 2-Norbornanethione, 1,3,3-trimethyl-, Proparacaine hydrochloride
| Molecular Formula | C10H16S |
|---|---|
| Molecular Weight | 168.10 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.09727 |
| Heavy Atoms | 11 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 875-06-9 |
|---|---|
| SMILES | CC1(C2CCC(C2)(C1=S)C)C |
| InChIKey | LZCJFUYIXHJWPV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫代葑酮 (CAS 875-06-9), with molecular formula C10H16S and molecular weight 168.10 g/mol. IUPAC: 1,3,3-trimethylbicyclo[2.2.1]heptane-2-thione.
Chemical Property Profile of 硫代葑酮
Property Insights of 硫代葑酮
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫代葑酮. With a topological polar surface area (TPSA) of 32.1 Ų, 硫代葑酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 硫代葑酮 has 0 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 硫代葑酮?
The CAS number of 硫代葑酮 is 875-06-9.
What is the molecular formula of 硫代葑酮?
The molecular formula of 硫代葑酮 is C10H16S.
What is the molecular weight of 硫代葑酮?
The molecular weight of 硫代葑酮 is 168.10 g/mol.
Where can I buy 硫代葑酮?
You can request a quote for 硫代葑酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫代葑酮?
Yes, KEHONG BIO provides custom synthesis services for 硫代葑酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.