N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide
TL;DR: N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide (CAS 528534-04-5) is a chemical compound with molecular formula C15H20N2O3S and molecular weight 308.11948 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide
Also Known As: N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide, N-[2-(cyclohexylsulfanyl)ethyl]-4-nitrobenzamide, Cambridge id 7145264
Technical Specifications
| Molecular Formula | C15H20N2O3S |
| Molecular Weight | 308.11948 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.11948 Da |
| Heavy Atoms | 21 |
| Complexity | 345.0 |
| SMILES | C1CCC(CC1)SCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | WRNKEDSJUXUZMZ-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide
Property Insights of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide
The XLogP value of 3.5 indicates that N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide 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 N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide 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
What is the CAS number of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide?
The CAS number of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide is 528534-04-5.
What is the molecular formula of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide?
The molecular formula of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide is C15H20N2O3S.
What is the molecular weight of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide?
The molecular weight of N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide is 308.11948 g/mol.
Where can I buy N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide?
You can request a quote for N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-(2-cyclohexylsulfanylethyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.