![{[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid structure](/static/products/448/448915-72-8.png)
{[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid
TL;DR: {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid (CAS 448915-72-8) is a chemical compound with molecular formula C13H11N3O4S and molecular weight 305.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(5-nitro-2-pyridinyl)amino]phenyl]sulfanylacetic acid
Also Known As: AJ-333/15478158, {[2-({5-nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid, 2-[2-[(5-nitropyridin-2-yl)amino]phenyl]sulfanylacetic acid
| Molecular Formula | C13H11N3O4S |
|---|---|
| Molecular Weight | 305.05 g/mol |
| LogP | 2.9101 |
| Topological Polar Surface Area | 105.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 305.04703 |
| Heavy Atoms | 21 |
| Complexity | 660.7209 |
Chemical Identifiers
| CAS Number | 448915-72-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2=NC=C(C=C2)[N+](=O)[O-])SCC(=O)O |
Product Overview
{[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid (CAS 448915-72-8), with molecular formula C13H11N3O4S and molecular weight 305.05 g/mol. IUPAC: 2-[2-[(5-nitro-2-pyridinyl)amino]phenyl]sulfanylacetic acid.
Chemical Property Profile of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid
Property Insights of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid
The XLogP value of 2.9101 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid. The TPSA of 105.36 Ų falls within the moderate polarity range, balancing permeability and solubility for {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid. Following Lipinski's Rule of Five, {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid has 2 hydrogen bond donor(s) and 6 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 {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid?
The CAS number of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid is 448915-72-8.
What is the molecular formula of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid?
The molecular formula of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid is C13H11N3O4S.
What is the molecular weight of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid?
The molecular weight of {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid is 305.05 g/mol.
Where can I buy {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid?
You can request a quote for {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid?
Yes, KEHONG BIO provides custom synthesis services for {[2-({5-Nitro-2-pyridinyl}amino)phenyl]sulfanyl}acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.