ChemDiv1_002926
TL;DR: ChemDiv1_002926 (CAS 313387-99-4) is a chemical compound with molecular formula C21H21F3N4O4 and molecular weight 450.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Also Known As: ChemDiv1_002926, BAS 01515740, AN-329/11640038, 5-(3,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide, [5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)(8-hydropyrazolo[1,5-a]pyrimidin-2 -yl)]-N-(oxolan-2-ylmethyl)carboxamide
| Molecular Formula | C21H21F3N4O4 |
|---|---|
| Molecular Weight | 450.15 g/mol |
| LogP | 3.3411 |
| Topological Polar Surface Area | 86.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1515 |
| Heavy Atoms | 32 |
| Complexity | 1140.0106 |
Chemical Identifiers
| CAS Number | 313387-99-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)NCC4CCCO4)OC |
Product Overview
ChemDiv1_002926 (CAS 313387-99-4), with molecular formula C21H21F3N4O4 and molecular weight 450.15 g/mol. IUPAC: 5-(3,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
Chemical Property Profile of ChemDiv1_002926
Property Insights of ChemDiv1_002926
The XLogP value of 3.3411 indicates that ChemDiv1_002926 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.98 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_002926. Following Lipinski's Rule of Five, ChemDiv1_002926 has 1 hydrogen bond donor(s) and 6 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_002926?
The CAS number of ChemDiv1_002926 is 313387-99-4.
What is the molecular formula of ChemDiv1_002926?
The molecular formula of ChemDiv1_002926 is C21H21F3N4O4.
What is the molecular weight of ChemDiv1_002926?
The molecular weight of ChemDiv1_002926 is 450.15 g/mol.
Where can I buy ChemDiv1_002926?
You can request a quote for ChemDiv1_002926 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002926?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002926 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.