4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione
TL;DR: 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione (CAS 695-68-1) is a chemical compound with molecular formula C4H9O2PS2 and molecular weight 183.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-sulfanyl-2-sulfanylidene-1,3,2λ5-dioxaphospholane
Also Known As: J2.337.723C, 4,5-dimethyl-2-sulfanyl-2-sulfanylidene-1,3,2, 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione, 2-Mercapto-4,5-dimethyl-1,3,2-dioxaphospholane-2-thione, 4,5-dimethyl-2-sulfanyl-1,3,2lambda5-dioxaphospholane-2-thione
| Molecular Formula | C4H9O2PS2 |
|---|---|
| Molecular Weight | 183.98 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 183.97816 |
| Heavy Atoms | 9 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 695-68-1 |
|---|---|
| SMILES | CC1C(OP(=S)(O1)S)C |
| InChIKey | RAFIXHZWWVZVSK-UHFFFAOYSA-N |
Product Overview
4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione (CAS 695-68-1), with molecular formula C4H9O2PS2 and molecular weight 183.98 g/mol. IUPAC: 4,5-dimethyl-2-sulfanyl-2-sulfanylidene-1,3,2λ5-dioxaphospholane.
Chemical Property Profile of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione
Property Insights of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione. With a topological polar surface area (TPSA) of 51.6 Ų, 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione has 1 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 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione?
The CAS number of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione is 695-68-1.
What is the molecular formula of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione?
The molecular formula of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione is C4H9O2PS2.
What is the molecular weight of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione?
The molecular weight of 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione is 183.98 g/mol.
Where can I buy 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione?
You can request a quote for 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-2-sulfanyl-1,3,2lambda~5~-dioxaphospholane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.