Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate
TL;DR: Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate (CAS 428459-51-2) is a chemical compound with molecular formula C16H17O5PS and molecular weight 352.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-diphenoxyphosphorylthiolane 1,1-dioxide
Also Known As: 3-diphenoxyphosphorylthiolane 1,1-dioxide, diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate, (1-hydroxy-1-oxothiolan-3-yl)diphenoxyphosphino-1-one, diphenyl (1,1-dioxidotetrahydrothiophen-3-yl)phosphonate
| Molecular Formula | C16H17O5PS |
|---|---|
| Molecular Weight | 352.05 g/mol |
| LogP | 3.5246 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.05344 |
| Heavy Atoms | 23 |
| Complexity | 759.37897 |
Chemical Identifiers
| CAS Number | 428459-51-2 |
|---|---|
| SMILES | C1CS(=O)(=O)CC1P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3 |
Product Overview
Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate (CAS 428459-51-2), with molecular formula C16H17O5PS and molecular weight 352.05 g/mol. IUPAC: 3-diphenoxyphosphorylthiolane 1,1-dioxide.
Chemical Property Profile of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate
Property Insights of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate
The XLogP value of 3.5246 indicates that Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate. Following Lipinski's Rule of Five, Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate has 0 hydrogen bond donor(s) and 5 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 Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate?
The CAS number of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate is 428459-51-2.
What is the molecular formula of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate?
The molecular formula of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate is C16H17O5PS.
What is the molecular weight of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate?
The molecular weight of Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate is 352.05 g/mol.
Where can I buy Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate?
You can request a quote for Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diphenyl (1,1-dioxidotetrahydro-3-thienyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.