ChemDiv1_012492
TL;DR: ChemDiv1_012492 (CAS 333764-67-3) is a chemical compound with molecular formula C17H13BrClF3N4O2 and molecular weight 475.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-bromophenyl)-3-chloro-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: ChemDiv1_012492, BAS 00924447, 5-(4-bromophenyl)-3-chloro-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
| Molecular Formula | C17H13BrClF3N4O2 |
|---|---|
| Molecular Weight | 475.99 g/mol |
| LogP | 4.2072 |
| Topological Polar Surface Area | 68.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.98624 |
| Heavy Atoms | 28 |
| Complexity | 1021.8998 |
Chemical Identifiers
| CAS Number | 333764-67-3 |
|---|---|
| SMILES | COCCNC(=O)C1=NN2C(=CC(=NC2=C1Cl)C3=CC=C(C=C3)Br)C(F)(F)F |
Product Overview
ChemDiv1_012492 (CAS 333764-67-3), with molecular formula C17H13BrClF3N4O2 and molecular weight 475.99 g/mol. IUPAC: 5-(4-bromophenyl)-3-chloro-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of ChemDiv1_012492
Property Insights of ChemDiv1_012492
The XLogP value of 4.2072 indicates that ChemDiv1_012492 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_012492. Following Lipinski's Rule of Five, ChemDiv1_012492 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_012492?
The CAS number of ChemDiv1_012492 is 333764-67-3.
What is the molecular formula of ChemDiv1_012492?
The molecular formula of ChemDiv1_012492 is C17H13BrClF3N4O2.
What is the molecular weight of ChemDiv1_012492?
The molecular weight of ChemDiv1_012492 is 475.99 g/mol.
Where can I buy ChemDiv1_012492?
You can request a quote for ChemDiv1_012492 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_012492?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_012492 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.