![[2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate structure](/static/products/852/852710-75-9.png)
[2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate
TL;DR: [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate (CAS 852710-75-9) is a chemical compound with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate
Also Known As: [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate|2-(2,5-dimethylphenyl)-2-oxoethyl 1H-indazole-3-carboxylate|MLS002251924|SMR000836401
| Molecular Formula | C18H16N2O3 |
|---|---|
| Molecular Weight | 308.12 g/mol |
| LogP | 3.21944 |
| Topological Polar Surface Area | 72.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.1161 |
| Heavy Atoms | 23 |
| Complexity | 896.17303 |
Chemical Identifiers
| CAS Number | 852710-75-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=NNC3=CC=CC=C32 |
Product Overview
[2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate (CAS 852710-75-9), with molecular formula C18H16N2O3 and molecular weight 308.12 g/mol. IUPAC: [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate.
Chemical Property Profile of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate
Property Insights of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate
The XLogP value of 3.21944 indicates that [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.05 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate. Following Lipinski's Rule of Five, [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate has 1 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-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate?
The CAS number of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate is 852710-75-9.
What is the molecular formula of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate?
The molecular formula of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate is C18H16N2O3.
What is the molecular weight of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate?
The molecular weight of [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate is 308.12 g/mol.
Where can I buy [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate?
You can request a quote for [2-(2,5-dimethylphenyl)-2-oxoethyl] 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-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2,5-dimethylphenyl)-2-oxoethyl] 1H-indazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.