![[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate structure](/static/products/100/1004438-76-9.png)
[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate
TL;DR: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate (CAS 1004438-76-9) is a chemical compound with molecular formula C14H11N3O3 and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate
Also Known As: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate|1h-indazole-3-carboxylic acid, 2-oxo-2-(1h-pyrrol-2-yl)ethyl ester
| Molecular Formula | C14H11N3O3 |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 1.9307 |
| Topological Polar Surface Area | 87.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 269.08005 |
| Heavy Atoms | 20 |
| Complexity | 758.9258 |
Chemical Identifiers
| CAS Number | 1004438-76-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=NN2)C(=O)OCC(=O)C3=CC=CN3 |
Product Overview
[2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate (CAS 1004438-76-9), with molecular formula C14H11N3O3 and molecular weight 269.08 g/mol. IUPAC: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate.
Chemical Property Profile of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate
Property Insights of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate
The XLogP value of 1.9307 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate. The TPSA of 87.84 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate. Following Lipinski's Rule of Five, [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate has 2 hydrogen bond donor(s) and 4 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-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate?
The CAS number of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate is 1004438-76-9.
What is the molecular formula of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate?
The molecular formula of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate is C14H11N3O3.
What is the molecular weight of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate?
The molecular weight of [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate is 269.08 g/mol.
Where can I buy [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate?
You can request a quote for [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 1H-indazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.