3-Phenylsulfanylthietane 1,1-dioxide
TL;DR: 3-Phenylsulfanylthietane 1,1-dioxide (CAS 75299-22-8) is a chemical compound with molecular formula C9H10O2S2 and molecular weight 214.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylsulfanylthietane 1,1-dioxide
Also Known As: 3-phenylsulfanylthietane 1,1-dioxide, 3-phenylsulfanyl-thietane 1,1-dioxide, 1,1-dioxido-3-thietanyl phenyl sulfide, 3-(phenylsulfanyl)thietane-1,1-dioxide, 3-(Phenylsulfanyl)-1lambda~6~-thietane-1,1-dione
| Molecular Formula | C9H10O2S2 |
|---|---|
| Molecular Weight | 214.01 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 214.01222 |
| Heavy Atoms | 13 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 75299-22-8 |
|---|---|
| SMILES | C1C(CS1(=O)=O)SC2=CC=CC=C2 |
| InChIKey | VSRPCFOCEHDNOE-UHFFFAOYSA-N |
Product Overview
3-Phenylsulfanylthietane 1,1-dioxide (CAS 75299-22-8), with molecular formula C9H10O2S2 and molecular weight 214.01 g/mol. IUPAC: 3-phenylsulfanylthietane 1,1-dioxide.
Chemical Property Profile of 3-Phenylsulfanylthietane 1,1-dioxide
Property Insights of 3-Phenylsulfanylthietane 1,1-dioxide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenylsulfanylthietane 1,1-dioxide. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Phenylsulfanylthietane 1,1-dioxide. Following Lipinski's Rule of Five, 3-Phenylsulfanylthietane 1,1-dioxide 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 3-Phenylsulfanylthietane 1,1-dioxide?
The CAS number of 3-Phenylsulfanylthietane 1,1-dioxide is 75299-22-8.
What is the molecular formula of 3-Phenylsulfanylthietane 1,1-dioxide?
The molecular formula of 3-Phenylsulfanylthietane 1,1-dioxide is C9H10O2S2.
What is the molecular weight of 3-Phenylsulfanylthietane 1,1-dioxide?
The molecular weight of 3-Phenylsulfanylthietane 1,1-dioxide is 214.01 g/mol.
Where can I buy 3-Phenylsulfanylthietane 1,1-dioxide?
You can request a quote for 3-Phenylsulfanylthietane 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylsulfanylthietane 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylsulfanylthietane 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.