dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate
TL;DR: dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate (CAS 678989-62-3) is a chemical compound with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate
Also Known As: diisopropyl 1H-pyrazole-3,5-dicarboxylate, Dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate
| Molecular Formula | C11H16N2O4 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 1.5401 |
| Topological Polar Surface Area | 81.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.11101 |
| Heavy Atoms | 17 |
| Complexity | 372.85886 |
Chemical Identifiers
| CAS Number | 678989-62-3 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC(=NN1)C(=O)OC(C)C |
Product Overview
dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate (CAS 678989-62-3), with molecular formula C11H16N2O4 and molecular weight 240.11 g/mol. IUPAC: dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate.
Chemical Property Profile of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate
Property Insights of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate
The XLogP value of 1.5401 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate. The TPSA of 81.28 Ų falls within the moderate polarity range, balancing permeability and solubility for dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate. Following Lipinski's Rule of Five, dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate has 1 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 dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate?
The CAS number of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate is 678989-62-3.
What is the molecular formula of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate?
The molecular formula of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate is C11H16N2O4.
What is the molecular weight of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate?
The molecular weight of dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate is 240.11 g/mol.
Where can I buy dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate?
You can request a quote for dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dipropan-2-yl 1H-pyrazole-3,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.