N-diethoxyphosphorylmethanethioamide
TL;DR: N-diethoxyphosphorylmethanethioamide (CAS 20446-90-6) is a chemical compound with molecular formula C5H12NO3PS and molecular weight 197.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-diethoxyphosphorylmethanethioamide
Also Known As: N-diethoxyphosphorylmethanethioamide, N-Diethylphosphono-thioformamid, Diethyl N-methanethioylphosphoramidate
| Molecular Formula | C5H12NO3PS |
|---|---|
| Molecular Weight | 197.03 g/mol |
| LogP | 1.7143 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 197.02756 |
| Heavy Atoms | 11 |
| Complexity | 153.80652 |
Chemical Identifiers
| CAS Number | 20446-90-6 |
|---|---|
| SMILES | CCOP(=O)(NC=S)OCC |
Product Overview
N-diethoxyphosphorylmethanethioamide (CAS 20446-90-6), with molecular formula C5H12NO3PS and molecular weight 197.03 g/mol. IUPAC: N-diethoxyphosphorylmethanethioamide.
Chemical Property Profile of N-diethoxyphosphorylmethanethioamide
Property Insights of N-diethoxyphosphorylmethanethioamide
The XLogP value of 1.7143 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-diethoxyphosphorylmethanethioamide. With a topological polar surface area (TPSA) of 47.56 Ų, N-diethoxyphosphorylmethanethioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-diethoxyphosphorylmethanethioamide 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 N-diethoxyphosphorylmethanethioamide?
The CAS number of N-diethoxyphosphorylmethanethioamide is 20446-90-6.
What is the molecular formula of N-diethoxyphosphorylmethanethioamide?
The molecular formula of N-diethoxyphosphorylmethanethioamide is C5H12NO3PS.
What is the molecular weight of N-diethoxyphosphorylmethanethioamide?
The molecular weight of N-diethoxyphosphorylmethanethioamide is 197.03 g/mol.
Where can I buy N-diethoxyphosphorylmethanethioamide?
You can request a quote for N-diethoxyphosphorylmethanethioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-diethoxyphosphorylmethanethioamide?
Yes, KEHONG BIO provides custom synthesis services for N-diethoxyphosphorylmethanethioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.