S-Methyl P-propylphosphonamidothioate
TL;DR: S-Methyl P-propylphosphonamidothioate (CAS 65331-54-6) is a chemical compound with molecular formula C4H12NOPS and molecular weight 153.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[amino(methylsulfanyl)phosphoryl]propane
Also Known As: p-Propylphosphonamidothioic acid S-methyl ester, S-Methyl n-propylphosphonamidothioate, S-Methyl P-propylphosphonamidothioate, 1-[amino(methylsulfanyl)phosphoryl]propane, Phosphonamidothioic acid, p-propyl-, S-methyl ester
| Molecular Formula | C4H12NOPS |
|---|---|
| Molecular Weight | 153.04 g/mol |
| LogP | 1.9112 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 153.03772 |
| Heavy Atoms | 8 |
| Complexity | 106.21143 |
Chemical Identifiers
| CAS Number | 65331-54-6 |
|---|---|
| SMILES | CCCP(=O)(N)SC |
Product Overview
S-Methyl P-propylphosphonamidothioate (CAS 65331-54-6), with molecular formula C4H12NOPS and molecular weight 153.04 g/mol. IUPAC: 1-[amino(methylsulfanyl)phosphoryl]propane.
Chemical Property Profile of S-Methyl P-propylphosphonamidothioate
Property Insights of S-Methyl P-propylphosphonamidothioate
The XLogP value of 1.9112 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-Methyl P-propylphosphonamidothioate. With a topological polar surface area (TPSA) of 43.09 Ų, S-Methyl P-propylphosphonamidothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-Methyl P-propylphosphonamidothioate has 1 hydrogen bond donor(s) and 2 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 S-Methyl P-propylphosphonamidothioate?
The CAS number of S-Methyl P-propylphosphonamidothioate is 65331-54-6.
What is the molecular formula of S-Methyl P-propylphosphonamidothioate?
The molecular formula of S-Methyl P-propylphosphonamidothioate is C4H12NOPS.
What is the molecular weight of S-Methyl P-propylphosphonamidothioate?
The molecular weight of S-Methyl P-propylphosphonamidothioate is 153.04 g/mol.
Where can I buy S-Methyl P-propylphosphonamidothioate?
You can request a quote for S-Methyl P-propylphosphonamidothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Methyl P-propylphosphonamidothioate?
Yes, KEHONG BIO provides custom synthesis services for S-Methyl P-propylphosphonamidothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.