4-(chloromethyl)-1,3-diphenyl-1H-pyrazole
TL;DR: 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole (CAS 55432-05-8) is a chemical compound with molecular formula C16H13ClN2 and molecular weight 268.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-1,3-diphenylpyrazole
Also Known As: 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole, 4-(chloromethyl)-1,3-diphenylpyrazole, 4-(chloromethyl)-1,3-diphenyl-pyrazole, 4-Chloromethyl-1,3-diphenyl-1H-pyrazole, 4-chloromethyl-1,3-diphenylpyrazole
| Molecular Formula | C16H13ClN2 |
|---|---|
| Molecular Weight | 268.08 g/mol |
| LogP | 4.2781 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.07672 |
| Heavy Atoms | 19 |
| Complexity | 659.73065 |
Chemical Identifiers
| CAS Number | 55432-05-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NN(C=C2CCl)C3=CC=CC=C3 |
Product Overview
4-(chloromethyl)-1,3-diphenyl-1H-pyrazole (CAS 55432-05-8), with molecular formula C16H13ClN2 and molecular weight 268.08 g/mol. IUPAC: 4-(chloromethyl)-1,3-diphenylpyrazole.
Chemical Property Profile of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole
Property Insights of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole
The XLogP value of 4.2781 indicates that 4-(chloromethyl)-1,3-diphenyl-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, 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole has 0 hydrogen bond donor(s) and 1 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 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole?
The CAS number of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole is 55432-05-8.
What is the molecular formula of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole?
The molecular formula of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole is C16H13ClN2.
What is the molecular weight of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole?
The molecular weight of 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole is 268.08 g/mol.
Where can I buy 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole?
You can request a quote for 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 4-(chloromethyl)-1,3-diphenyl-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.