2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate
TL;DR: 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate (CAS 692771-04-3) is a chemical compound with molecular formula C19H17ClN2O3 and molecular weight 356.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-acetyl-3-phenyl-3,4-dihydropyrazol-5-yl)-4-chlorophenyl] acetate
Also Known As: 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate, [2-(2-acetyl-3-phenyl-3,4-dihydropyrazol-5-yl)-4-chlorophenyl] acetate
| Molecular Formula | C19H17ClN2O3 |
|---|---|
| Molecular Weight | 356.09 g/mol |
| LogP | 3.9629 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.09277 |
| Heavy Atoms | 25 |
| Complexity | 849.0026 |
Chemical Identifiers
| CAS Number | 692771-04-3 |
|---|---|
| SMILES | CC(=O)N1C(CC(=N1)C2=C(C=CC(=C2)Cl)OC(=O)C)C3=CC=CC=C3 |
Product Overview
2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate (CAS 692771-04-3), with molecular formula C19H17ClN2O3 and molecular weight 356.09 g/mol. IUPAC: [2-(2-acetyl-3-phenyl-3,4-dihydropyrazol-5-yl)-4-chlorophenyl] acetate.
Chemical Property Profile of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate
Property Insights of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate
The XLogP value of 3.9629 indicates that 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate has 0 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-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate?
The CAS number of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate is 692771-04-3.
What is the molecular formula of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate?
The molecular formula of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate is C19H17ClN2O3.
What is the molecular weight of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate?
The molecular weight of 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate is 356.09 g/mol.
Where can I buy 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate?
You can request a quote for 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-acetyl-5-phenyl-4,5-dihydro-1H-pyrazol-3-yl)-4-chlorophenyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.