![[1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py structure](/static/products/853/85380-92-3.png)
[1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py
TL;DR: [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py (CAS 85380-92-3) is a chemical compound with molecular formula C17H19NO2S2 and molecular weight 333.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-methyl-5-(2-methylsulfanyl-2-methylsulfinylethenyl)pyrrol-2-yl]-(4-methylphenyl)methanone
Also Known As: [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py|(1-Methyl-5-(2-(methylsulfinyl)-2-(methylthio)vinyl)-1H-pyrrol-2-yl)(4-methylphenyl)methanone|[1-methyl-5-(2-methylsulfanyl-2-methylsulfinylethenyl)pyrrol-2-yl]-(4-methylphenyl)methanone|MLS003171383|SMR001875283
| Molecular Formula | C17H19NO2S2 |
|---|---|
| Molecular Weight | 333.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 83.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.08572 |
| Heavy Atoms | 22 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 85380-92-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C2=CC=C(N2C)C=C(SC)S(=O)C |
| InChIKey | IMDGWKNOHSOJHJ-UHFFFAOYSA-N |
Product Overview
[1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py (CAS 85380-92-3), with molecular formula C17H19NO2S2 and molecular weight 333.09 g/mol. IUPAC: [1-methyl-5-(2-methylsulfanyl-2-methylsulfinylethenyl)pyrrol-2-yl]-(4-methylphenyl)methanone.
Chemical Property Profile of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py
Property Insights of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py
The XLogP value of 3.0 indicates that [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py. Following Lipinski's Rule of Five, [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py 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 [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py?
The CAS number of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py is 85380-92-3.
What is the molecular formula of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py?
The molecular formula of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py is C17H19NO2S2.
What is the molecular weight of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py?
The molecular weight of [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py is 333.09 g/mol.
Where can I buy [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py?
You can request a quote for [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py?
Yes, KEHONG BIO provides custom synthesis services for [1-methyl-5-[(E)-2-methylsulfanyl-2-methylsulfinylethenyl]py and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.