1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole
TL;DR: 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole (CAS 313670-88-1) is a chemical compound with molecular formula C22H17BrN2O and molecular weight 404.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4-bromophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone
Also Known As: 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole, AH-034/36849040, [5-(4-bromophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone
| Molecular Formula | C22H17BrN2O |
|---|---|
| Molecular Weight | 404.05 g/mol |
| LogP | 5.4406 |
| Topological Polar Surface Area | 32.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.05243 |
| Heavy Atoms | 26 |
| Complexity | 936.8959 |
Chemical Identifiers
| CAS Number | 313670-88-1 |
|---|---|
| SMILES | C1C(N(N=C1C2=CC=C(C=C2)Br)C(=O)C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole (CAS 313670-88-1), with molecular formula C22H17BrN2O and molecular weight 404.05 g/mol. IUPAC: [5-(4-bromophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-phenylmethanone.
Chemical Property Profile of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole
Property Insights of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole
The XLogP value of 5.4406 indicates that 1-benzoyl-3-(4-bromophenyl)-5-phenyl-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-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole?
The CAS number of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole is 313670-88-1.
What is the molecular formula of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole?
The molecular formula of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole is C22H17BrN2O.
What is the molecular weight of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole?
The molecular weight of 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole is 404.05 g/mol.
Where can I buy 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole?
You can request a quote for 1-benzoyl-3-(4-bromophenyl)-5-phenyl-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-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-benzoyl-3-(4-bromophenyl)-5-phenyl-4,5-dihydro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.