1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole
TL;DR: 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole (CAS 306958-11-2) is a chemical compound with molecular formula C17H15ClN2O and molecular weight 298.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)ethanone
Also Known As: 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole, 2-chloro-1-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)ethanone, 2-chloro-1-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)ethanone, 2-chloro-1-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)ethan-1-one
| Molecular Formula | C17H15ClN2O |
|---|---|
| Molecular Weight | 298.09 g/mol |
| LogP | 3.6031 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.08728 |
| Heavy Atoms | 21 |
| Complexity | 655.005 |
Chemical Identifiers
| CAS Number | 306958-11-2 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=CC=C2)C(=O)CCl)C3=CC=CC=C3 |
Product Overview
1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole (CAS 306958-11-2), with molecular formula C17H15ClN2O and molecular weight 298.09 g/mol. IUPAC: 2-chloro-1-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)ethanone.
Chemical Property Profile of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole
Property Insights of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole
The XLogP value of 3.6031 indicates that 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.67 Ų, 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole has 0 hydrogen bond donor(s) and 2 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 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole?
The CAS number of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole is 306958-11-2.
What is the molecular formula of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole?
The molecular formula of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole is C17H15ClN2O.
What is the molecular weight of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole?
The molecular weight of 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole is 298.09 g/mol.
Where can I buy 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole?
You can request a quote for 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(chloroacetyl)-3,5-diphenyl-4,5-dihydro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.