US11718589, Compound 40a
TL;DR: US11718589, Compound 40a (CAS 348151-19-9) is a chemical compound with molecular formula C20H19F3N4O and molecular weight 388.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone
Also Known As: US11718589, Compound 40a, BAS 01059188, 5-(4-methylphenyl)-2-(1-piperidinylcarbonyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine, AN-329/13197582, [5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone
| Molecular Formula | C20H19F3N4O |
|---|---|
| Molecular Weight | 388.15 g/mol |
| LogP | 4.34962 |
| Topological Polar Surface Area | 50.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 388.1511 |
| Heavy Atoms | 28 |
| Complexity | 1018.3471 |
Chemical Identifiers
| CAS Number | 348151-19-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)N4CCCCC4 |
Product Overview
US11718589, Compound 40a (CAS 348151-19-9), with molecular formula C20H19F3N4O and molecular weight 388.15 g/mol. IUPAC: [5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]-piperidin-1-ylmethanone.
Chemical Property Profile of US11718589, Compound 40a
Property Insights of US11718589, Compound 40a
The XLogP value of 4.34962 indicates that US11718589, Compound 40a is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.5 Ų, US11718589, Compound 40a exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, US11718589, Compound 40a has 0 hydrogen bond donor(s) and 3 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 US11718589, Compound 40a?
The CAS number of US11718589, Compound 40a is 348151-19-9.
What is the molecular formula of US11718589, Compound 40a?
The molecular formula of US11718589, Compound 40a is C20H19F3N4O.
What is the molecular weight of US11718589, Compound 40a?
The molecular weight of US11718589, Compound 40a is 388.15 g/mol.
Where can I buy US11718589, Compound 40a?
You can request a quote for US11718589, Compound 40a directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for US11718589, Compound 40a?
Yes, KEHONG BIO provides custom synthesis services for US11718589, Compound 40a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.