![1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone structure](/static/products/4382/438232-79-2.webp)
1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone
TL;DR: 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone (CAS 438232-79-2) is a chemical compound with molecular formula C17H13BrF4N2O3 and molecular weight 448.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone
Also Known As: 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone, 1-{[(6-bromo-2-naphthyl)oxy]acetyl}-3,5-bis(difluoromethyl)-4,5-dihydro-1H-pyrazol-5-ol, 1-[3,5-BIS(DIFLUOROMETHYL)-5-HYDROXY-4,5-DIHYDRO-1H-PYRAZOL-1-YL]-2-[(6-BROMO-2-NAPHTHYL)OXY]-1-ETHANONE, 1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-[(6-bromonaphthalen-2-yl)oxy]ethanone
| Molecular Formula | C17H13BrF4N2O3 |
|---|---|
| Molecular Weight | 448.00 g/mol |
| LogP | 3.7882 |
| Topological Polar Surface Area | 62.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.00458 |
| Heavy Atoms | 27 |
| Complexity | 908.87756 |
Chemical Identifiers
| CAS Number | 438232-79-2 |
|---|---|
| SMILES | C1C(=NN(C1(C(F)F)O)C(=O)COC2=CC3=C(C=C2)C=C(C=C3)Br)C(F)F |
Product Overview
1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone (CAS 438232-79-2), with molecular formula C17H13BrF4N2O3 and molecular weight 448.00 g/mol. IUPAC: 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone.
Chemical Property Profile of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone
Property Insights of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone
The XLogP value of 3.7882 indicates that 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone. Following Lipinski's Rule of Five, 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone has 1 hydrogen bond donor(s) and 4 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-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone?
The CAS number of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone is 438232-79-2.
What is the molecular formula of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone?
The molecular formula of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone is C17H13BrF4N2O3.
What is the molecular weight of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone?
The molecular weight of 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone is 448.00 g/mol.
Where can I buy 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone?
You can request a quote for 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-[3,5-bis(difluoromethyl)-5-hydroxy-4H-pyrazol-1-yl]-2-(6-bromonaphthalen-2-yl)oxyethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.