ChemDiv1_012478
TL;DR: ChemDiv1_012478 (CAS 355416-49-8) is a chemical compound with molecular formula C15H15BrF3N3O3 and molecular weight 421.02 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-(3,4-dimethoxyphenyl)acetamide
Also Known As: ChemDiv1_012478, BAS 00414863, AB00093275-01, 2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-N-(3,4-dimethoxyphenyl)acetamide, AN-329/10497058
| Molecular Formula | C15H15BrF3N3O3 |
|---|---|
| Molecular Weight | 421.02 g/mol |
| LogP | 3.62872 |
| Topological Polar Surface Area | 65.38 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.0249 |
| Heavy Atoms | 25 |
| Complexity | 790.3044 |
Chemical Identifiers
| CAS Number | 355416-49-8 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CC(=C(C=C2)OC)OC)C(F)(F)F)Br |
Product Overview
ChemDiv1_012478 (CAS 355416-49-8), with molecular formula C15H15BrF3N3O3 and molecular weight 421.02 g/mol. IUPAC: 2-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(3,4-dimethoxyphenyl)acetamide.
Chemical Property Profile of ChemDiv1_012478
Property Insights of ChemDiv1_012478
The XLogP value of 3.62872 indicates that ChemDiv1_012478 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.38 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_012478. Following Lipinski's Rule of Five, ChemDiv1_012478 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 ChemDiv1_012478?
The CAS number of ChemDiv1_012478 is 355416-49-8.
What is the molecular formula of ChemDiv1_012478?
The molecular formula of ChemDiv1_012478 is C15H15BrF3N3O3.
What is the molecular weight of ChemDiv1_012478?
The molecular weight of ChemDiv1_012478 is 421.02 g/mol.
Where can I buy ChemDiv1_012478?
You can request a quote for ChemDiv1_012478 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012478?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012478 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.