3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide
TL;DR: 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide (CAS 941998-86-3) is a chemical compound with molecular formula C16H16N2O4S and molecular weight 332.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide
Also Known As: 3-(ethylthio)-N-(4-methoxy-2-nitrophenyl)benzamide, 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide, F2647-0201, 3-(ethylsulfanyl)-N-(4-methoxy-2-nitrophenyl)benzamide, N-(4-methoxy-2-nitrophenyl)m-(ethylthio)benzamide
| Molecular Formula | C16H16N2O4S |
|---|---|
| Molecular Weight | 332.08 g/mol |
| LogP | 3.9677 |
| Topological Polar Surface Area | 81.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.08307 |
| Heavy Atoms | 23 |
| Complexity | 733.7702 |
Chemical Identifiers
| CAS Number | 941998-86-3 |
|---|---|
| SMILES | CCSC1=CC=CC(=C1)C(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-] |
Product Overview
3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide (CAS 941998-86-3), with molecular formula C16H16N2O4S and molecular weight 332.08 g/mol. IUPAC: 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide.
Chemical Property Profile of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide
Property Insights of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide
The XLogP value of 3.9677 indicates that 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 5 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 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide?
The CAS number of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide is 941998-86-3.
What is the molecular formula of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide?
The molecular formula of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide is C16H16N2O4S.
What is the molecular weight of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide?
The molecular weight of 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide is 332.08 g/mol.
Where can I buy 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide?
You can request a quote for 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-ethylsulfanyl-N-(4-methoxy-2-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.