Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester
TL;DR: Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester (CAS 54473-56-2) is a chemical compound with molecular formula C7H12NO3PS and molecular weight 221.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[methoxy(prop-2-ynylsulfanyl)phosphoryl]propanamide
Also Known As: (1-Oxopropyl)phosphoramidothioic acid O-methyl S-2-propynyl ester, Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester, Phosphoramidothioic acid, (1-oxopropyl)-, O-methyl S-2-propynyl ester, N-[methoxy(prop-2-ynylsulfanyl)phosphoryl]propanamide, N-{Methoxy[(prop-2-yn-1-yl)sulfanyl]phosphoryl}propanimidic acid
| Molecular Formula | C7H12NO3PS |
|---|---|
| Molecular Weight | 221.03 g/mol |
| LogP | 1.6335 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.02756 |
| Heavy Atoms | 13 |
| Complexity | 260.9535 |
Chemical Identifiers
| CAS Number | 54473-56-2 |
|---|---|
| SMILES | CCC(=O)NP(=O)(OC)SCC#C |
Product Overview
Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester (CAS 54473-56-2), with molecular formula C7H12NO3PS and molecular weight 221.03 g/mol. IUPAC: N-[methoxy(prop-2-ynylsulfanyl)phosphoryl]propanamide.
Chemical Property Profile of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester
Property Insights of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester
The XLogP value of 1.6335 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester. With a topological polar surface area (TPSA) of 55.4 Ų, Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester 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 Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester?
The CAS number of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester is 54473-56-2.
What is the molecular formula of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester?
The molecular formula of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester is C7H12NO3PS.
What is the molecular weight of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester?
The molecular weight of Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester is 221.03 g/mol.
Where can I buy Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester?
You can request a quote for Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoramidothioic acid, propionyl-, O-methyl S-2-propynyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.