C16H11ClF3N3O
TL;DR: C16H11ClF3N3O (CAS 848436-24-8) is a chemical compound with molecular formula C16H11ClF3N3O and molecular weight 353.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride
Also Known As: 5-(3,4-dimethylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride, 5-(3,4-Dimethyl-phenyl)-7-trifluoromethyl-pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride, 5-(3,4-Dimethylphenyl)-7-(trifluoromethyl)-pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride, pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride, 5-(3,4-dimethylphenyl)-7-(trifluoromethyl)-, 5-(3,4-Dimethylphenyl)-7-(trifluoromethyl)-pyrazolo1,5-apyrimidine-2-carbonyl Chloride
| Molecular Formula | C16H11ClF3N3O |
|---|---|
| Molecular Weight | 353.05 g/mol |
| LogP | 4.41094 |
| Topological Polar Surface Area | 47.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 353.05426 |
| Heavy Atoms | 24 |
| Complexity | 963.09143 |
Chemical Identifiers
| CAS Number | 848436-24-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)Cl)C |
Product Overview
C16H11ClF3N3O (CAS 848436-24-8), with molecular formula C16H11ClF3N3O and molecular weight 353.05 g/mol. IUPAC: 5-(3,4-dimethylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride.
Chemical Property Profile of C16H11ClF3N3O
Property Insights of C16H11ClF3N3O
The XLogP value of 4.41094 indicates that C16H11ClF3N3O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.26 Ų, C16H11ClF3N3O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C16H11ClF3N3O 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 C16H11ClF3N3O?
The CAS number of C16H11ClF3N3O is 848436-24-8.
What is the molecular formula of C16H11ClF3N3O?
The molecular formula of C16H11ClF3N3O is C16H11ClF3N3O.
What is the molecular weight of C16H11ClF3N3O?
The molecular weight of C16H11ClF3N3O is 353.05 g/mol.
Where can I buy C16H11ClF3N3O?
You can request a quote for C16H11ClF3N3O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16H11ClF3N3O?
Yes, KEHONG BIO provides custom synthesis services for C16H11ClF3N3O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.