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7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one
TL;DR: 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one (CAS 5525-99-5) is a chemical compound with molecular formula C18H17O4PS and molecular weight 360.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one
Also Known As: 7-[ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one, O-Ethyl O-(4-methyl-2-oxo-2H-1-benzopyran-7-yl) phenylphosphonothioate
| Molecular Formula | C18H17O4PS |
|---|---|
| Molecular Weight | 360.06 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 76.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.0585 |
| Heavy Atoms | 24 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 5525-99-5 |
|---|---|
| SMILES | CCOP(=S)(C1=CC=CC=C1)OC2=CC3=C(C=C2)C(=CC(=O)O3)C |
| InChIKey | FUWISUNNCHZSMK-UHFFFAOYSA-N |
Product Overview
7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one (CAS 5525-99-5), with molecular formula C18H17O4PS and molecular weight 360.06 g/mol. IUPAC: 7-[ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one.
Chemical Property Profile of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one
Property Insights of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one
The XLogP value of 4.8 indicates that 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one. Following Lipinski's Rule of Five, 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one has 0 hydrogen bond donor(s) and 5 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 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one?
The CAS number of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one is 5525-99-5.
What is the molecular formula of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one?
The molecular formula of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one is C18H17O4PS.
What is the molecular weight of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one?
The molecular weight of 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one is 360.06 g/mol.
Where can I buy 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one?
You can request a quote for 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-[Ethoxy(phenyl)phosphinothioyl]oxy-4-methylchromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.