Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-
TL;DR: Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- (CAS 20404-97-1) is a chemical compound with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[1-(4-methylphenyl)sulfanyl-2-nitroethyl]phenyl]acetamide
Also Known As: 4'-(2-Nitro-1-(p-tolylthio)ethyl)acetanilide, ACETANILIDE, 4'-(2-NITRO-1-(p-TOLYLTHIO)ETHYL)-, n-[4-[1-[thio]-2-nitroethyl]phenyl]acetamide, N-[4-[1-[ thio]-2-nitroethyl]phenyl]acetamide, Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-
| Molecular Formula | C17H18N2O3S |
|---|---|
| Molecular Weight | 330.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.10382 |
| Heavy Atoms | 23 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 20404-97-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SC(C[N+](=O)[O-])C2=CC=C(C=C2)NC(=O)C |
| InChIKey | FEYDRETXYFWGJR-UHFFFAOYSA-N |
Product Overview
Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- (CAS 20404-97-1), with molecular formula C17H18N2O3S and molecular weight 330.10 g/mol. IUPAC: N-[4-[1-(4-methylphenyl)sulfanyl-2-nitroethyl]phenyl]acetamide.
Chemical Property Profile of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-
Property Insights of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-
The XLogP value of 3.3 indicates that Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-. Following Lipinski's Rule of Five, Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- 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 Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-?
The CAS number of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- is 20404-97-1.
What is the molecular formula of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-?
The molecular formula of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- is C17H18N2O3S.
What is the molecular weight of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-?
The molecular weight of Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- is 330.10 g/mol.
Where can I buy Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-?
You can request a quote for Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Acetamide, N-((1-((4-methylphenyl)thio)-2-nitroethyl)phenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.