![2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol structure](/static/products/4237/423753-91-7.webp)
2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol
TL;DR: 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol (CAS 423753-91-7) is a chemical compound with molecular formula C16H13BrN2O and molecular weight 328.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-bromophenyl)-1H-pyrazol-5-yl]-5-methylphenol
Also Known As: 2-(5-(3-Bromophenyl)-1H-pyrazol-3-yl)-5-methylphenol, 2-[5-(3-BROMOPHENYL)-1H-PYRAZOL-3-YL]-5-METHYLPHENOL, CHEMBRDG-BB 5971672, BAS 01121881, 1H-PYRROLO[3,4-G]QUINOXALINE
| Molecular Formula | C16H13BrN2O |
|---|---|
| Molecular Weight | 328.02 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.02112 |
| Heavy Atoms | 20 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 423753-91-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C2=CC(=NN2)C3=CC(=CC=C3)Br)O |
| InChIKey | KHNMWEACJGZVLT-UHFFFAOYSA-N |
Product Overview
2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol (CAS 423753-91-7), with molecular formula C16H13BrN2O and molecular weight 328.02 g/mol. IUPAC: 2-[3-(3-bromophenyl)-1H-pyrazol-5-yl]-5-methylphenol.
Chemical Property Profile of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol
Property Insights of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol
The XLogP value of 4.2 indicates that 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.9 Ų, 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol has 2 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 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol?
The CAS number of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol is 423753-91-7.
What is the molecular formula of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol?
The molecular formula of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol is C16H13BrN2O.
What is the molecular weight of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol?
The molecular weight of 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol is 328.02 g/mol.
Where can I buy 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol?
You can request a quote for 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-[5-(3-Bromophenyl)-1H-pyrazol-3-YL]-5-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.