(1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine
TL;DR: (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine (CAS 142168-75-0) is a chemical compound with molecular formula C10H12N2O2S and molecular weight 224.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(1-methylsulfanyl-2-nitroethenyl)aniline
Also Known As: 4-methyl-N-(1-methylsulfanyl-2-nitroethenyl)aniline, Benzenamine, 4-methyl-N-[1-(methylthio)-2-nitroethenyl]-, (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine, 4-methyl-N-[1-(methylsulfanyl)-2-nitrovinyl]aniline, 4-Methyl-N-[1-(methylsulfanyl)-2-nitroethen-1-yl]aniline
| Molecular Formula | C10H12N2O2S |
|---|---|
| Molecular Weight | 224.06 g/mol |
| LogP | 2.84552 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.06195 |
| Heavy Atoms | 15 |
| Complexity | 373.5137 |
Chemical Identifiers
| CAS Number | 142168-75-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=C[N+](=O)[O-])SC |
Product Overview
(1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine (CAS 142168-75-0), with molecular formula C10H12N2O2S and molecular weight 224.06 g/mol. IUPAC: 4-methyl-N-(1-methylsulfanyl-2-nitroethenyl)aniline.
Chemical Property Profile of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine
Property Insights of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine
The XLogP value of 2.84552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine. With a topological polar surface area (TPSA) of 55.17 Ų, (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine has 1 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-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine?
The CAS number of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine is 142168-75-0.
What is the molecular formula of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine?
The molecular formula of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine is C10H12N2O2S.
What is the molecular weight of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine?
The molecular weight of (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine is 224.06 g/mol.
Where can I buy (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine?
You can request a quote for (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine?
Yes, KEHONG BIO provides custom synthesis services for (1-Methylsulfanyl-2-nitro-vinyl)-p-tolyl-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.