4-Pob-mts
TL;DR: 4-Pob-mts (CAS 887407-33-2) is a chemical compound with molecular formula C8H11O6PS2 and molecular weight 297.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(methylsulfonylsulfanylmethyl)phenyl] dihydrogen phosphate
Also Known As: 4-POB-MTS, 4-Phosphoryloxybenzyl Methanethiosulfonate, [4-(methylsulfonylsulfanylmethyl)phenyl] dihydrogen phosphate, [4-(methylsulfonylsulfanylmethyl)phenoxy]phosphonic Acid, S-{[4-(Phosphonooxy)phenyl]methyl} methanesulfonothioate
| Molecular Formula | C8H11O6PS2 |
|---|---|
| Molecular Weight | 297.97 g/mol |
| LogP | 1.3509 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.97348 |
| Heavy Atoms | 17 |
| Complexity | 517.4513 |
Chemical Identifiers
| CAS Number | 887407-33-2 |
|---|---|
| SMILES | CS(=O)(=O)SCC1=CC=C(C=C1)OP(=O)(O)O |
Product Overview
4-Pob-mts (CAS 887407-33-2), with molecular formula C8H11O6PS2 and molecular weight 297.97 g/mol. IUPAC: [4-(methylsulfonylsulfanylmethyl)phenyl] dihydrogen phosphate.
Chemical Property Profile of 4-Pob-mts
Property Insights of 4-Pob-mts
The XLogP value of 1.3509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pob-mts. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pob-mts. Following Lipinski's Rule of Five, 4-Pob-mts has 2 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 4-Pob-mts?
The CAS number of 4-Pob-mts is 887407-33-2.
What is the molecular formula of 4-Pob-mts?
The molecular formula of 4-Pob-mts is C8H11O6PS2.
What is the molecular weight of 4-Pob-mts?
The molecular weight of 4-Pob-mts is 297.97 g/mol.
Where can I buy 4-Pob-mts?
You can request a quote for 4-Pob-mts directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pob-mts?
Yes, KEHONG BIO provides custom synthesis services for 4-Pob-mts and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.