S-(1-Pyrenylmethyl) methanesulfonothioate
TL;DR: S-(1-Pyrenylmethyl) methanesulfonothioate (CAS 384342-65-8) is a chemical compound with molecular formula C18H14O2S2 and molecular weight 326.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(methylsulfonylsulfanylmethyl)pyrene
Also Known As: 1-Pyrenylmethyl methanethiosulfonate, Pyrene-1-MTS, 1-(methylsulfonylsulfanylmethyl)pyrene, 1-PyrenylmethylMethanethiosulfonate, S-(1-Pyrenylmethyl) methanesulfonothioate
| Molecular Formula | C18H14O2S2 |
|---|---|
| Molecular Weight | 326.04 g/mol |
| LogP | 4.7768 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.04352 |
| Heavy Atoms | 22 |
| Complexity | 1082.4382 |
Chemical Identifiers
| CAS Number | 384342-65-8 |
|---|---|
| SMILES | CS(=O)(=O)SCC1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1 |
Product Overview
S-(1-Pyrenylmethyl) methanesulfonothioate (CAS 384342-65-8), with molecular formula C18H14O2S2 and molecular weight 326.04 g/mol. IUPAC: 1-(methylsulfonylsulfanylmethyl)pyrene.
Chemical Property Profile of S-(1-Pyrenylmethyl) methanesulfonothioate
Property Insights of S-(1-Pyrenylmethyl) methanesulfonothioate
The XLogP value of 4.7768 indicates that S-(1-Pyrenylmethyl) methanesulfonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, S-(1-Pyrenylmethyl) methanesulfonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-(1-Pyrenylmethyl) methanesulfonothioate has 0 hydrogen bond donor(s) and 3 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 S-(1-Pyrenylmethyl) methanesulfonothioate?
The CAS number of S-(1-Pyrenylmethyl) methanesulfonothioate is 384342-65-8.
What is the molecular formula of S-(1-Pyrenylmethyl) methanesulfonothioate?
The molecular formula of S-(1-Pyrenylmethyl) methanesulfonothioate is C18H14O2S2.
What is the molecular weight of S-(1-Pyrenylmethyl) methanesulfonothioate?
The molecular weight of S-(1-Pyrenylmethyl) methanesulfonothioate is 326.04 g/mol.
Where can I buy S-(1-Pyrenylmethyl) methanesulfonothioate?
You can request a quote for S-(1-Pyrenylmethyl) methanesulfonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(1-Pyrenylmethyl) methanesulfonothioate?
Yes, KEHONG BIO provides custom synthesis services for S-(1-Pyrenylmethyl) methanesulfonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.