(2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide
TL;DR: (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide (CAS 70898-34-9) is a chemical compound with molecular formula C8H18NO6PS2 and molecular weight 319.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide
Also Known As: VAMIDOTHION SULFONE, (S)-3-Methyl-2-ketopiperazine, (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide, (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methyl-propanamide, Phosphorothioic acid, O,O-dimethyl S-(2-((1-methyl-2-(methylamino)-2-oxoethyl)sulfonyl)ethyl) ester
| Molecular Formula | C8H18NO6PS2 |
|---|---|
| Molecular Weight | 319.03 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 319.0313 |
| Heavy Atoms | 18 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 70898-34-9 |
|---|---|
| SMILES | C[C@@H](C(=O)NC)S(=O)(=O)CCOP(=S)(OC)OC |
| InChIKey | HNRQYFFHOBWJPZ-ZETCQYMHSA-N |
Product Overview
(2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide (CAS 70898-34-9), with molecular formula C8H18NO6PS2 and molecular weight 319.03 g/mol. IUPAC: (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide.
Chemical Property Profile of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide
Property Insights of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide. Following Lipinski's Rule of Five, (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide has 1 hydrogen bond donor(s) and 7 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 (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide?
The CAS number of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide is 70898-34-9.
What is the molecular formula of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide?
The molecular formula of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide is C8H18NO6PS2.
What is the molecular weight of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide?
The molecular weight of (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide is 319.03 g/mol.
Where can I buy (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide?
You can request a quote for (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(2-dimethoxyphosphinothioyloxyethylsulfonyl)-N-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.