ChemDiv1_000877
TL;DR: ChemDiv1_000877 (CAS 314048-59-4) is a chemical compound with molecular formula C22H17F3N4O3 and molecular weight 442.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dimethoxyphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: ChemDiv1_000877, BAS 00398198, N-(2,4-dimethoxyphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, N-(2,4-dimethoxyphenyl)[5-phenyl-7-(trifluoromethyl)(8-hydropyrazolo[1,5-a]pyr imidin-2-yl)]carboxamide
| Molecular Formula | C22H17F3N4O3 |
|---|---|
| Molecular Weight | 442.13 g/mol |
| LogP | 4.6846 |
| Topological Polar Surface Area | 77.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.12527 |
| Heavy Atoms | 32 |
| Complexity | 1287.0659 |
Chemical Identifiers
| CAS Number | 314048-59-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=CC=C4)C(F)(F)F)OC |
Product Overview
ChemDiv1_000877 (CAS 314048-59-4), with molecular formula C22H17F3N4O3 and molecular weight 442.13 g/mol. IUPAC: N-(2,4-dimethoxyphenyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of ChemDiv1_000877
Property Insights of ChemDiv1_000877
The XLogP value of 4.6846 indicates that ChemDiv1_000877 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.75 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_000877. Following Lipinski's Rule of Five, ChemDiv1_000877 has 1 hydrogen bond donor(s) and 5 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_000877?
The CAS number of ChemDiv1_000877 is 314048-59-4.
What is the molecular formula of ChemDiv1_000877?
The molecular formula of ChemDiv1_000877 is C22H17F3N4O3.
What is the molecular weight of ChemDiv1_000877?
The molecular weight of ChemDiv1_000877 is 442.13 g/mol.
Where can I buy ChemDiv1_000877?
You can request a quote for ChemDiv1_000877 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_000877?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_000877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.