RefChem:1058735
TL;DR: RefChem:1058735 (CAS 107788-12-5) is a chemical compound with molecular formula C20H20O4S and molecular weight 356.10822 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3E)-3-[[3-ethoxy-4-hydroxy-5-(phenylsulfanylmethyl)phenyl]methylidene]oxolan-2-one
Also Known As: (E)-hex-1-en-1-ol, Dihydro-3-((3-ethoxy-4-hydroxy-5-((phenylthio)methyl)phenyl)methylene)-2(3H)-furanone, 2(3H)-Furanone, dihydro-3-((3-ethoxy-4-hydroxy-5-((phenylthio)methyl)phenyl)methylene)-, (3E)-3-[[3-ethoxy-4-hydroxy-5-(phenylsulfanylmethyl)phenyl]methylidene]oxolan-2-one, 2(3H)-Furanone, dihydro-3-((3-ethoxy-4-hydroxy-5-((phenylthio)methyl)p henyl)methylene)-
Technical Specifications
| Molecular Formula | C20H20O4S |
| Molecular Weight | 356.10822 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 81.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.10822 Da |
| Heavy Atoms | 25 |
| Complexity | 472.0 |
| SMILES | CCOC1=CC(=CC(=C1O)CSC2=CC=CC=C2)/C=C/3\CCOC3=O |
| InChIKey | PTLUDKAYBMPHQI-XNTDXEJSSA-N |
Chemical Property Profile of RefChem:1058735
Property Insights of RefChem:1058735
The XLogP value of 4.2 indicates that RefChem:1058735 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1058735. Following Lipinski's Rule of Five, RefChem:1058735 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1058735?
The CAS number of RefChem:1058735 is 107788-12-5.
What is the molecular formula of RefChem:1058735?
The molecular formula of RefChem:1058735 is C20H20O4S.
What is the molecular weight of RefChem:1058735?
The molecular weight of RefChem:1058735 is 356.10822 g/mol.
Where can I buy RefChem:1058735?
You can request a quote for RefChem:1058735 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1058735?
Yes, CoreyChem provides custom synthesis services for RefChem:1058735 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.