Peakdale1_000514
TL;DR: Peakdale1_000514 (CAS 396129-67-2) is a chemical compound with molecular formula C20H18F3N3O and molecular weight 373.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-1-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]propan-1-one
Also Known As: Peakdale1_000514, 2,2-Dimethyl-1-[4-(4-pyridinyl)-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl]-1-propanone, 2,2-dimethyl-1-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]propan-1-one, 2,2-Dimethyl-1-{4-(pyridin-4-yl)-3-[4-(trifluoromethyl)phenyl]-1H-pyrazol-1-yl}propan-1-one
| Molecular Formula | C20H18F3N3O |
|---|---|
| Molecular Weight | 373.14 g/mol |
| LogP | 5.3172 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 373.1402 |
| Heavy Atoms | 27 |
| Complexity | 952.87726 |
Chemical Identifiers
| CAS Number | 396129-67-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)N1C=C(C(=N1)C2=CC=C(C=C2)C(F)(F)F)C3=CC=NC=C3 |
Product Overview
Peakdale1_000514 (CAS 396129-67-2), with molecular formula C20H18F3N3O and molecular weight 373.14 g/mol. IUPAC: 2,2-dimethyl-1-[4-pyridin-4-yl-3-[4-(trifluoromethyl)phenyl]pyrazol-1-yl]propan-1-one.
Chemical Property Profile of Peakdale1_000514
Property Insights of Peakdale1_000514
The XLogP value of 5.3172 indicates that Peakdale1_000514 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.78 Ų, Peakdale1_000514 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Peakdale1_000514 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Peakdale1_000514?
The CAS number of Peakdale1_000514 is 396129-67-2.
What is the molecular formula of Peakdale1_000514?
The molecular formula of Peakdale1_000514 is C20H18F3N3O.
What is the molecular weight of Peakdale1_000514?
The molecular weight of Peakdale1_000514 is 373.14 g/mol.
Where can I buy Peakdale1_000514?
You can request a quote for Peakdale1_000514 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Peakdale1_000514?
Yes, KEHONG BIO provides custom synthesis services for Peakdale1_000514 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.