Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester
TL;DR: Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester (CAS 63870-39-3) is a chemical compound with molecular formula C8H18NO3PS and molecular weight 239.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[methoxy(methylsulfanyl)phosphoryl]hexanamide
Also Known As: o,s-dimethyl hexanoylphosphoramidothioate, (1-Oxohexyl)phosphoramidothioic acid O,S-dimethyl ester, Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester, Phosphoramidothioic acid, (1-oxohexyl)-, O,S-dimethyl ester, N-[methoxy(methylsulfanyl)phosphoryl]hexanamide
| Molecular Formula | C8H18NO3PS |
|---|---|
| Molecular Weight | 239.07 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 239.07451 |
| Heavy Atoms | 14 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 63870-39-3 |
|---|---|
| SMILES | CCCCCC(=O)NP(=O)(OC)SC |
| InChIKey | HKLZEKPTKPZRQB-UHFFFAOYSA-N |
Product Overview
Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester (CAS 63870-39-3), with molecular formula C8H18NO3PS and molecular weight 239.07 g/mol. IUPAC: N-[methoxy(methylsulfanyl)phosphoryl]hexanamide.
Chemical Property Profile of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester
Property Insights of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester. Following Lipinski's Rule of Five, Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl 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, hexanoyl-, O,S-dimethyl ester?
The CAS number of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester is 63870-39-3.
What is the molecular formula of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester?
The molecular formula of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester is C8H18NO3PS.
What is the molecular weight of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester?
The molecular weight of Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester is 239.07 g/mol.
Where can I buy Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester?
You can request a quote for Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl 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, hexanoyl-, O,S-dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoramidothioic acid, hexanoyl-, O,S-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.