![2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene structure](/static/products/359/35903-41-4.png)
2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene
TL;DR: 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene (CAS 35903-41-4) is a chemical compound with molecular formula C15H13NO2S and molecular weight 271.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene
Also Known As: 2-(methylsulfanyl)-1-nitro-4-(2-phenylethenyl)benzene, 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene, 2-methylsulfanyl-1-nitro-4-(2-phenylethenyl)benzene, 1,2,4-Triazin-5(4H)-one,3-(methylthio)-4-nitroso-6-phenyl
| Molecular Formula | C15H13NO2S |
|---|---|
| Molecular Weight | 271.07 g/mol |
| LogP | 4.4871 |
| Topological Polar Surface Area | 43.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.0667 |
| Heavy Atoms | 19 |
| Complexity | 608.79755 |
Chemical Identifiers
| CAS Number | 35903-41-4 |
|---|---|
| SMILES | CSC1=C(C=CC(=C1)/C=C/C2=CC=CC=C2)[N+](=O)[O-] |
Product Overview
2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene (CAS 35903-41-4), with molecular formula C15H13NO2S and molecular weight 271.07 g/mol. IUPAC: 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene.
Chemical Property Profile of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene
Property Insights of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene
The XLogP value of 4.4871 indicates that 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.14 Ų, 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene has 0 hydrogen bond donor(s) and 3 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-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene?
The CAS number of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene is 35903-41-4.
What is the molecular formula of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene?
The molecular formula of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene is C15H13NO2S.
What is the molecular weight of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene?
The molecular weight of 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene is 271.07 g/mol.
Where can I buy 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene?
You can request a quote for 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 2-methylsulfanyl-1-nitro-4-[(E)-2-phenylethenyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.