(4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid
TL;DR: (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid (CAS 693813-00-2) is a chemical compound with molecular formula C16H14N2O7 and molecular weight 346.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[[2-(3-nitrophenoxy)acetyl]amino]phenoxy]acetic acid
Also Known As: (4-{[(3-nitrophenoxy)acetyl]amino}phenoxy)acetic acid, 2-[4-[[2-(3-nitrophenoxy)acetyl]amino]phenoxy]acetic Acid, 2-(4-(2-(3-nitrophenoxy)acetamido)phenoxy)acetic acid
| Molecular Formula | C16H14N2O7 |
|---|---|
| Molecular Weight | 346.08 g/mol |
| LogP | 2.0757 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 346.0801 |
| Heavy Atoms | 25 |
| Complexity | 774.3076 |
Chemical Identifiers
| CAS Number | 693813-00-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OCC(=O)NC2=CC=C(C=C2)OCC(=O)O)[N+](=O)[O-] |
Product Overview
(4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid (CAS 693813-00-2), with molecular formula C16H14N2O7 and molecular weight 346.08 g/mol. IUPAC: 2-[4-[[2-(3-nitrophenoxy)acetyl]amino]phenoxy]acetic acid.
Chemical Property Profile of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid
Property Insights of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid
The XLogP value of 2.0757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid. Following Lipinski's Rule of Five, (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)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 (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid?
The CAS number of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid is 693813-00-2.
What is the molecular formula of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid?
The molecular formula of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid is C16H14N2O7.
What is the molecular weight of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid?
The molecular weight of (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid is 346.08 g/mol.
Where can I buy (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid?
You can request a quote for (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-{[(3-Nitrophenoxy)acetyl]amino}phenoxy)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.