Pluridone
TL;DR: Pluridone (CAS 88640-29-3) is a chemical compound with molecular formula C12H12O3S and molecular weight 236.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-methyl (E)-3-phenacyloxyprop-2-enethioate
Also Known As: Pluridone, S-methyl (E)-3-phenacyloxyprop-2-enethioate, (E)-1-methylsulfanyl-3-phenacyloxy-prop-2-en-1-one
| Molecular Formula | C12H12O3S |
|---|---|
| Molecular Weight | 236.05 g/mol |
| LogP | 2.2892 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 236.05072 |
| Heavy Atoms | 16 |
| Complexity | 384.51016 |
Chemical Identifiers
| CAS Number | 88640-29-3 |
|---|---|
| SMILES | CSC(=O)/C=C/OCC(=O)C1=CC=CC=C1 |
Product Overview
Pluridone (CAS 88640-29-3), with molecular formula C12H12O3S and molecular weight 236.05 g/mol. IUPAC: S-methyl (E)-3-phenacyloxyprop-2-enethioate.
Chemical Property Profile of Pluridone
Property Insights of Pluridone
The XLogP value of 2.2892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pluridone. With a topological polar surface area (TPSA) of 43.37 Ų, Pluridone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pluridone has 0 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 Pluridone?
The CAS number of Pluridone is 88640-29-3.
What is the molecular formula of Pluridone?
The molecular formula of Pluridone is C12H12O3S.
What is the molecular weight of Pluridone?
The molecular weight of Pluridone is 236.05 g/mol.
Where can I buy Pluridone?
You can request a quote for Pluridone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pluridone?
Yes, KEHONG BIO provides custom synthesis services for Pluridone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.