![2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester structure](/static/products/1077/107788-10-3.webp)
2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester
TL;DR: 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester (CAS 107788-10-3) is a chemical compound with molecular formula C21H24O6S2 and molecular weight 436.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[3-ethoxy-4-hydroxy-5-(phenylsulfanylmethyl)phenyl]-2-methylsulfonylprop-2-enoate
Also Known As: 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester, 2-Propenoic acid, 3-(3-ethoxy-4-hydroxy-5-((phenylthio)methyl)phenyl)-2-(methylsulfonyl)-, ethyl ester
| Molecular Formula | C21H24O6S2 |
|---|---|
| Molecular Weight | 436.10 g/mol |
| LogP | 4.0318 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 436.10144 |
| Heavy Atoms | 29 |
| Complexity | 981.73096 |
Chemical Identifiers
| CAS Number | 107788-10-3 |
|---|---|
| SMILES | CCOC1=CC(=CC(=C1O)CSC2=CC=CC=C2)C=C(C(=O)OCC)S(=O)(=O)C |
Product Overview
2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester (CAS 107788-10-3), with molecular formula C21H24O6S2 and molecular weight 436.10 g/mol. IUPAC: ethyl 3-[3-ethoxy-4-hydroxy-5-(phenylsulfanylmethyl)phenyl]-2-methylsulfonylprop-2-enoate.
Chemical Property Profile of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester
Property Insights of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester
The XLogP value of 4.0318 indicates that 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester. Following Lipinski's Rule of Five, 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester has 1 hydrogen bond donor(s) and 7 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 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester?
The CAS number of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester is 107788-10-3.
What is the molecular formula of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester?
The molecular formula of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester is C21H24O6S2.
What is the molecular weight of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester?
The molecular weight of 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester is 436.10 g/mol.
Where can I buy 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester?
You can request a quote for 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid,3-[3-ethoxy-4-hydroxy-5-[(phenylthio)methyl]phenyl]-2-(methylsulfonyl)-, ethylester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.