![N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide structure](/static/products/4382/438230-94-5.webp)
N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide
TL;DR: N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide (CAS 438230-94-5) is a chemical compound with molecular formula C11H14N2O4S and molecular weight 270.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]propanamide
Also Known As: N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide, N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]propanamide, N-[5-(2-hydroxyethylthio)-3-nitrophenyl]propanamide
| Molecular Formula | C11H14N2O4S |
|---|---|
| Molecular Weight | 270.07 g/mol |
| LogP | 2.0277 |
| Topological Polar Surface Area | 92.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 270.0674 |
| Heavy Atoms | 18 |
| Complexity | 450.6694 |
Chemical Identifiers
| CAS Number | 438230-94-5 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=CC(=C1)SCCO)[N+](=O)[O-] |
Product Overview
N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide (CAS 438230-94-5), with molecular formula C11H14N2O4S and molecular weight 270.07 g/mol. IUPAC: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]propanamide.
Chemical Property Profile of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide
Property Insights of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide
The XLogP value of 2.0277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide. The TPSA of 92.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide. Following Lipinski's Rule of Five, N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide 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-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide?
The CAS number of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide is 438230-94-5.
What is the molecular formula of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide?
The molecular formula of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide is C11H14N2O4S.
What is the molecular weight of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide?
The molecular weight of N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide is 270.07 g/mol.
Where can I buy N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide?
You can request a quote for N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide 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-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.