Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester
TL;DR: Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester (CAS 83695-71-0) is a chemical compound with molecular formula C16H20NO2PS and molecular weight 321.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[methoxy(phenylsulfanyl)phosphoryl]-3-phenylpropan-1-amine
Also Known As: 3-((1,1-Dimethylethoxy)methyl)heptane, Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester, N-[methoxy(phenylsulfanyl)phosphoryl]-3-phenylpropan-1-amine, O-Methyl S-phenyl N-(3-phenylpropyl)phosphoramidothioate, N-(METHOXY-PHENYLSULFANYL-PHOSPHORYL)-3-PHENYL-PROPAN-1-AMINE
| Molecular Formula | C16H20NO2PS |
|---|---|
| Molecular Weight | 321.10 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 321.09525 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 83695-71-0 |
|---|---|
| SMILES | COP(=O)(NCCCC1=CC=CC=C1)SC2=CC=CC=C2 |
| InChIKey | PKCGKPFWCYOBAM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester (CAS 83695-71-0), with molecular formula C16H20NO2PS and molecular weight 321.10 g/mol. IUPAC: N-[methoxy(phenylsulfanyl)phosphoryl]-3-phenylpropan-1-amine.
Chemical Property Profile of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester
Property Insights of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester
The XLogP value of 3.5 indicates that Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester. Following Lipinski's Rule of Five, Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl 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, phenylpropyl-, O-methyl S-phenyl ester?
The CAS number of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester is 83695-71-0.
What is the molecular formula of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester?
The molecular formula of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester is C16H20NO2PS.
What is the molecular weight of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester?
The molecular weight of Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester is 321.10 g/mol.
Where can I buy Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester?
You can request a quote for Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl 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, phenylpropyl-, O-methyl S-phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoramidothioic acid, phenylpropyl-, O-methyl S-phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.