Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate
TL;DR: Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate (CAS 618069-97-9) is a chemical compound with molecular formula C15H16N2O4 and molecular weight 288.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 1-(2,3-dimethylphenyl)pyrazole-3,4-dicarboxylate
Also Known As: Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate, Dimethyl 1-(2,3-dimethylphenyl)pyrazole-3,4-dicarboxylate
| Molecular Formula | C15H16N2O4 |
|---|---|
| Molecular Weight | 288.11 g/mol |
| LogP | 2.06234 |
| Topological Polar Surface Area | 70.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.111 |
| Heavy Atoms | 21 |
| Complexity | 670.19434 |
Chemical Identifiers
| CAS Number | 618069-97-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C=C(C(=N2)C(=O)OC)C(=O)OC)C |
Product Overview
Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate (CAS 618069-97-9), with molecular formula C15H16N2O4 and molecular weight 288.11 g/mol. IUPAC: dimethyl 1-(2,3-dimethylphenyl)pyrazole-3,4-dicarboxylate.
Chemical Property Profile of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate
Property Insights of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate
The XLogP value of 2.06234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate. The TPSA of 70.42 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate has 0 hydrogen bond donor(s) and 5 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 Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate?
The CAS number of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate is 618069-97-9.
What is the molecular formula of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate?
The molecular formula of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate is C15H16N2O4.
What is the molecular weight of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate?
The molecular weight of Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate is 288.11 g/mol.
Where can I buy Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate?
You can request a quote for Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 1-(2,3-dimethylphenyl)-1H-pyrazole-3,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.