5-Azidoalrestatin
TL;DR: 5-Azidoalrestatin (CAS 103884-86-2) is a chemical compound with molecular formula C14H8N4O4 and molecular weight 296.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-azido-1,3-dioxobenzo[de]isoquinolin-2-yl)acetic acid
Also Known As: 5-Azidoalrestatin, 2-(5-azido-1,3-dioxobenzo[de]isoquinolin-2-yl)acetic acid, 1H-Benz[de]isoquinoline-2(3H)-aceticacid, 5-azido-1,3-dioxo-, (5-Azido-1,3-dioxo-1H,3H-benzo[de]isoquinolin-2-yl)-acetic acid, (5-azido-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetic acid
| Molecular Formula | C14H8N4O4 |
|---|---|
| Molecular Weight | 296.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 89.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 296.05457 |
| Heavy Atoms | 22 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 103884-86-2 |
|---|---|
| SMILES | C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CC(=O)O)N=[N+]=[N-] |
| InChIKey | NTAXZRBNZZHEHN-UHFFFAOYSA-N |
Product Overview
5-Azidoalrestatin (CAS 103884-86-2), with molecular formula C14H8N4O4 and molecular weight 296.05 g/mol. IUPAC: 2-(5-azido-1,3-dioxobenzo[de]isoquinolin-2-yl)acetic acid.
Chemical Property Profile of 5-Azidoalrestatin
Property Insights of 5-Azidoalrestatin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Azidoalrestatin. The TPSA of 89.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Azidoalrestatin. Following Lipinski's Rule of Five, 5-Azidoalrestatin has 1 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 5-Azidoalrestatin?
The CAS number of 5-Azidoalrestatin is 103884-86-2.
What is the molecular formula of 5-Azidoalrestatin?
The molecular formula of 5-Azidoalrestatin is C14H8N4O4.
What is the molecular weight of 5-Azidoalrestatin?
The molecular weight of 5-Azidoalrestatin is 296.05 g/mol.
Where can I buy 5-Azidoalrestatin?
You can request a quote for 5-Azidoalrestatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Azidoalrestatin?
Yes, KEHONG BIO provides custom synthesis services for 5-Azidoalrestatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.