1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-
TL;DR: 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- (CAS 125048-87-5) is a chemical compound with molecular formula C11H7ClF3N3O and molecular weight 289.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
Also Known As: 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-, 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(trifluoromethyl)-1h-pyrazole-4-carboxamide
| Molecular Formula | C11H7ClF3N3O |
|---|---|
| Molecular Weight | 289.02 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.02298 |
| Heavy Atoms | 19 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 125048-87-5 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=C(C=N2)C(=O)N)C(F)(F)F)Cl |
| InChIKey | WRBPEEIYYHCTIE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- (CAS 125048-87-5), with molecular formula C11H7ClF3N3O and molecular weight 289.02 g/mol. IUPAC: 1-(4-chlorophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide.
Chemical Property Profile of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-
Property Insights of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-. Following Lipinski's Rule of Five, 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- 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 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-?
The CAS number of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- is 125048-87-5.
What is the molecular formula of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-?
The molecular formula of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- is C11H7ClF3N3O.
What is the molecular weight of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-?
The molecular weight of 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- is 289.02 g/mol.
Where can I buy 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-?
You can request a quote for 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole-4-carboxamide, 1-(4-chlorophenyl)-5-(triluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.