N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide
TL;DR: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide (CAS 438230-17-2) is a chemical compound with molecular formula C10H12N2O4S and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide
Also Known As: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide, N-[5-(2-hydroxyethylthio)-3-nitrophenyl]acetamide, N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}acetamide, N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]acetamide, N~1~-{3-[(2-HYDROXYETHYL)SULFANYL]-5-NITROPHENYL}ACETAMIDE
| Molecular Formula | C10H12N2O4S |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 1.6376 |
| Topological Polar Surface Area | 92.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.0518 |
| Heavy Atoms | 17 |
| Complexity | 436.31412 |
Chemical Identifiers
| CAS Number | 438230-17-2 |
|---|---|
| SMILES | CC(=O)NC1=CC(=CC(=C1)SCCO)[N+](=O)[O-] |
Product Overview
N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide (CAS 438230-17-2), with molecular formula C10H12N2O4S and molecular weight 256.05 g/mol. IUPAC: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide.
Chemical Property Profile of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide
Property Insights of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide
The XLogP value of 1.6376 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide. The TPSA of 92.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide. Following Lipinski's Rule of Five, N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide has 2 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 N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide?
The CAS number of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide is 438230-17-2.
What is the molecular formula of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide?
The molecular formula of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide is C10H12N2O4S.
What is the molecular weight of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide?
The molecular weight of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide is 256.05 g/mol.
Where can I buy N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide?
You can request a quote for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.