[2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine
TL;DR: [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine (CAS 324056-27-1) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-N-(2-nitrophenyl)sulfanylethanamine
Also Known As: [2-(3,4-dimethoxyphenyl)ethyl](2-nitrophenylthio)amine|SR-01000474811-1|2-(3,4-dimethoxyphenyl)-N-(2-nitrophenyl)sulfanylethanamine|N-(3,4-dimethoxyphenethyl)-S-(2-nitrophenyl)thiohydroxylamine|F0896-0359|[2-(3,4-dimethoxyphenyl)ethyl][(2-nitrophenyl)sulfanyl]amine
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 3.4514 |
| Topological Polar Surface Area | 73.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 678.8799 |
Chemical Identifiers
| CAS Number | 324056-27-1 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNSC2=CC=CC=C2[N+](=O)[O-])OC |
Product Overview
[2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine (CAS 324056-27-1), with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-N-(2-nitrophenyl)sulfanylethanamine.
Chemical Property Profile of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine
Property Insights of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine
The XLogP value of 3.4514 indicates that [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.63 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine. Following Lipinski's Rule of Five, [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine has 1 hydrogen bond donor(s) and 6 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-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine?
The CAS number of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine is 324056-27-1.
What is the molecular formula of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine?
The molecular formula of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine is C16H18N2O4S.
What is the molecular weight of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine?
The molecular weight of [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine is 334.10 g/mol.
Where can I buy [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine?
You can request a quote for [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine?
Yes, KEHONG BIO provides custom synthesis services for [2-(3,4-Dimethoxyphenyl)ethyl](2-nitrophenylthio)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.