Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-
TL;DR: Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- (CAS 72973-05-8) is a chemical compound with molecular formula C26H34NO4PS and molecular weight 487.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenylpiperidin-4-ol
Also Known As: Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-, (2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenyl-piperidin-4-ol, (2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenylpiperidin-4-ol, S-{[(2S,3R,4R,6R)-4-Hydroxy-3-methyl-2,6-diphenylpiperidin-4-yl]ethynyl} O,O-dipropyl phosphorothioate, RefChem:371446
| Molecular Formula | C26H34NO4PS |
|---|---|
| Molecular Weight | 487.19 g/mol |
| LogP | 6.4849 |
| Topological Polar Surface Area | 67.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 487.1946 |
| Heavy Atoms | 33 |
| Complexity | 966.03644 |
Chemical Identifiers
| CAS Number | 72973-05-8 |
|---|---|
| SMILES | CCCOP(=O)(OCCC)SC#C[C@]1(C[C@@H](N[C@@H]([C@H]1C)C2=CC=CC=C2)C3=CC=CC=C3)O |
Product Overview
Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- (CAS 72973-05-8), with molecular formula C26H34NO4PS and molecular weight 487.19 g/mol. IUPAC: (2S,3R,4R,6R)-4-(2-dipropoxyphosphorylsulfanylethynyl)-3-methyl-2,6-diphenylpiperidin-4-ol.
Chemical Property Profile of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-
Property Insights of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-
The XLogP value of 6.4849 indicates that Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.79 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-. Following Lipinski's Rule of Five, Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-?
The CAS number of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- is 72973-05-8.
What is the molecular formula of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-?
The molecular formula of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- is C26H34NO4PS.
What is the molecular weight of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-?
The molecular weight of Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- is 487.19 g/mol.
Where can I buy Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-?
You can request a quote for Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)-?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, S-((4-hydroxy-3-methyl-2,6-diphenyl-4-piperidinyl)ethynyl) O,O-dipropyl ester, (2-alpha,3-beta,4-beta,6-alpha)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.