ChemDiv1_012608
TL;DR: ChemDiv1_012608 (CAS 351520-80-4) is a chemical compound with molecular formula C14H10BrF6N3O and molecular weight 428.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: ChemDiv1_012608, BAS 00398047, AB00093205-01, BRD-K27175586-001-01-4, 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C14H10BrF6N3O |
|---|---|
| Molecular Weight | 428.99 g/mol |
| LogP | 4.63032 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 428.99115 |
| Heavy Atoms | 25 |
| Complexity | 796.8404 |
Chemical Identifiers
| CAS Number | 351520-80-4 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CC=CC=C2C(F)(F)F)C(F)(F)F)Br |
Product Overview
ChemDiv1_012608 (CAS 351520-80-4), with molecular formula C14H10BrF6N3O and molecular weight 428.99 g/mol. IUPAC: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of ChemDiv1_012608
Property Insights of ChemDiv1_012608
The XLogP value of 4.63032 indicates that ChemDiv1_012608 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.92 Ų, ChemDiv1_012608 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_012608 has 1 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 ChemDiv1_012608?
The CAS number of ChemDiv1_012608 is 351520-80-4.
What is the molecular formula of ChemDiv1_012608?
The molecular formula of ChemDiv1_012608 is C14H10BrF6N3O.
What is the molecular weight of ChemDiv1_012608?
The molecular weight of ChemDiv1_012608 is 428.99 g/mol.
Where can I buy ChemDiv1_012608?
You can request a quote for ChemDiv1_012608 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012608?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012608 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.