![(Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione structure](/static/products/5327/53271-54-8.webp)
(Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione
TL;DR: (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione (CAS 53271-54-8) is a chemical compound with molecular formula C12H18O2S3 and molecular weight 290.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-adamantylsulfonylmethanedithioate
Also Known As: methyl 1-adamantylsulfonylmethanedithioate, Methanedithioic acid,7)]dec-1-ylsulfonyl)-, methyl ester, (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione
| Molecular Formula | C12H18O2S3 |
|---|---|
| Molecular Weight | 290.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 99.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.0469 |
| Heavy Atoms | 17 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 53271-54-8 |
|---|---|
| SMILES | CSC(=S)S(=O)(=O)C12CC3CC(C1)CC(C3)C2 |
| InChIKey | ATAHFOBYKFVVDQ-UHFFFAOYSA-N |
Product Overview
(Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione (CAS 53271-54-8), with molecular formula C12H18O2S3 and molecular weight 290.05 g/mol. IUPAC: methyl 1-adamantylsulfonylmethanedithioate.
Chemical Property Profile of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione
Property Insights of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione
The XLogP value of 3.6 indicates that (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.9 Ų falls within the moderate polarity range, balancing permeability and solubility for (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione. Following Lipinski's Rule of Five, (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione has 0 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 (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione?
The CAS number of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione is 53271-54-8.
What is the molecular formula of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione?
The molecular formula of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione is C12H18O2S3.
What is the molecular weight of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione?
The molecular weight of (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione is 290.05 g/mol.
Where can I buy (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione?
You can request a quote for (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione?
Yes, KEHONG BIO provides custom synthesis services for (Methylsulfanyl)(tricyclo[3.3.1.1~3,7~]decane-1-sulfonyl)methanethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.