C15H14ClFN6
TL;DR: C15H14ClFN6 (CAS 313361-65-8) is a chemical compound with molecular formula C15H14ClFN6 and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(5-chloro-2-fluorophenyl)-N-[3-(3,5-dimethylpyrazol-1-yl)-5-methyl-1,2,4-triazol-4-yl]methanimine
Also Known As: CDS1_003201, (E)-1-(5-CHLORO-2-FLUOROPHENYL)-N-[3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-5-METHYL-4H-1,2,4-TRIAZOL-4-YL]METHANIMINE, (E)-N-(5-chloro-2-fluorobenzylidene)-3-(3,5-dimethyl-1H-pyrazol-1-yl)-5-methyl-4H-1,2,4-triazol-4-amine, 4-[(1E)-2-(5-chloro-2-fluorophenyl)-1-azavinyl]-3-(3,5-dimethylpyrazolyl)-5-me thyl-1,2,4-triazole, N-[(E)-(5-chloro-2-fluorophenyl)methylidene]-3-(3,5-dimethyl-1H-pyrazol-1-yl)-5-methyl-4H-1,2,4-triazol-4-amine
| Molecular Formula | C15H14ClFN6 |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 3.06376 |
| Topological Polar Surface Area | 60.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.09525 |
| Heavy Atoms | 23 |
| Complexity | 895.50684 |
Chemical Identifiers
| CAS Number | 313361-65-8 |
|---|---|
| SMILES | CC1=CC(=NN1C2=NN=C(N2/N=C/C3=C(C=CC(=C3)Cl)F)C)C |
Product Overview
C15H14ClFN6 (CAS 313361-65-8), with molecular formula C15H14ClFN6 and molecular weight 332.10 g/mol. IUPAC: (E)-1-(5-chloro-2-fluorophenyl)-N-[3-(3,5-dimethylpyrazol-1-yl)-5-methyl-1,2,4-triazol-4-yl]methanimine.
Chemical Property Profile of C15H14ClFN6
Property Insights of C15H14ClFN6
The XLogP value of 3.06376 indicates that C15H14ClFN6 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.89 Ų falls within the moderate polarity range, balancing permeability and solubility for C15H14ClFN6. Following Lipinski's Rule of Five, C15H14ClFN6 has 0 hydrogen bond donor(s) and 4 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 C15H14ClFN6?
The CAS number of C15H14ClFN6 is 313361-65-8.
What is the molecular formula of C15H14ClFN6?
The molecular formula of C15H14ClFN6 is C15H14ClFN6.
What is the molecular weight of C15H14ClFN6?
The molecular weight of C15H14ClFN6 is 332.10 g/mol.
Where can I buy C15H14ClFN6?
You can request a quote for C15H14ClFN6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H14ClFN6?
Yes, KEHONG BIO provides custom synthesis services for C15H14ClFN6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.