CBKinase1_001032
TL;DR: CBKinase1_001032 (CAS 351987-92-3) is a chemical compound with molecular formula C16H17ClF3N3O4 and molecular weight 407.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Also Known As: CBKinase1_001032, CBKinase1_013432, BAS 01058437, AB00098513-01, AE-848/13197019
| Molecular Formula | C16H17ClF3N3O4 |
|---|---|
| Molecular Weight | 407.09 g/mol |
| LogP | 3.52822 |
| Topological Polar Surface Area | 74.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 407.08597 |
| Heavy Atoms | 27 |
| Complexity | 827.1616 |
Chemical Identifiers
| CAS Number | 351987-92-3 |
|---|---|
| SMILES | CC1=C(C(=NN1CC(=O)NC2=CC(=C(C(=C2)OC)OC)OC)C(F)(F)F)Cl |
Product Overview
CBKinase1_001032 (CAS 351987-92-3), with molecular formula C16H17ClF3N3O4 and molecular weight 407.09 g/mol. IUPAC: 2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(3,4,5-trimethoxyphenyl)acetamide.
Chemical Property Profile of CBKinase1_001032
Property Insights of CBKinase1_001032
The XLogP value of 3.52822 indicates that CBKinase1_001032 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.61 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_001032. Following Lipinski's Rule of Five, CBKinase1_001032 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 CBKinase1_001032?
The CAS number of CBKinase1_001032 is 351987-92-3.
What is the molecular formula of CBKinase1_001032?
The molecular formula of CBKinase1_001032 is C16H17ClF3N3O4.
What is the molecular weight of CBKinase1_001032?
The molecular weight of CBKinase1_001032 is 407.09 g/mol.
Where can I buy CBKinase1_001032?
You can request a quote for CBKinase1_001032 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBKinase1_001032?
Yes, KEHONG BIO provides custom synthesis services for CBKinase1_001032 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.