3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole
TL;DR: 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole (CAS 372107-20-5) is a chemical compound with molecular formula C16H12BrClN2 and molecular weight 345.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-bromophenyl)-4-(chloromethyl)-1-phenylpyrazole
Also Known As: 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole, 3-(4-bromophenyl)-4-(chloromethyl)-1-phenylpyrazole, T0503-6723, 1H-Pyrazole, 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-
| Molecular Formula | C16H12BrClN2 |
|---|---|
| Molecular Weight | 345.99 g/mol |
| LogP | 5.0406 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.98724 |
| Heavy Atoms | 20 |
| Complexity | 705.1016 |
Chemical Identifiers
| CAS Number | 372107-20-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Br)CCl |
Product Overview
3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole (CAS 372107-20-5), with molecular formula C16H12BrClN2 and molecular weight 345.99 g/mol. IUPAC: 3-(4-bromophenyl)-4-(chloromethyl)-1-phenylpyrazole.
Chemical Property Profile of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole
Property Insights of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole
The XLogP value of 5.0406 indicates that 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole?
The CAS number of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole is 372107-20-5.
What is the molecular formula of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole?
The molecular formula of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole is C16H12BrClN2.
What is the molecular weight of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole?
The molecular weight of 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole is 345.99 g/mol.
Where can I buy 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole?
You can request a quote for 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-bromophenyl)-4-(chloromethyl)-1-phenyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.