N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
TL;DR: N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide (CAS 1025724-93-9) is a chemical compound with molecular formula C12H10F3N3O and molecular weight 269.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
Also Known As: N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide, 2X-0823, N-benzyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxamide, 1H-Pyrazole-4-carboxamide, N-(phenylmethyl)-3-(trifluoromethyl)-
| Molecular Formula | C12H10F3N3O |
|---|---|
| Molecular Weight | 269.08 g/mol |
| LogP | 2.3585 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.0776 |
| Heavy Atoms | 19 |
| Complexity | 563.09863 |
Chemical Identifiers
| CAS Number | 1025724-93-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)C2=C(NN=C2)C(F)(F)F |
Product Overview
N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide (CAS 1025724-93-9), with molecular formula C12H10F3N3O and molecular weight 269.08 g/mol. IUPAC: N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide.
Chemical Property Profile of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
Property Insights of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide
The XLogP value of 2.3585 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide. With a topological polar surface area (TPSA) of 57.78 Ų, N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide has 2 hydrogen bond donor(s) and 2 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 N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide?
The CAS number of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide is 1025724-93-9.
What is the molecular formula of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide?
The molecular formula of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide is C12H10F3N3O.
What is the molecular weight of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide?
The molecular weight of N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide is 269.08 g/mol.
Where can I buy N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide?
You can request a quote for N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-benzyl-5-(trifluoromethyl)-1H-pyrazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.