1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole
TL;DR: 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole (CAS 114676-82-3) is a chemical compound with molecular formula C14H12ClN3 and molecular weight 257.07196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-5-phenyl-4,5-dihydrotriazole
Also Known As: KST-1A9928, 1-(4-chlorophenyl)-5-phenyl-4,5-dihydrotriazole, 1-(4-chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole, 4,5-Diphenyl-furan-dicarbonsaeure-dimethylester-(2,3), 1H-1,2,3-Triazole,1-(4-chlorophenyl)-4,5-dihydro-5-phenyl-
Technical Specifications
| Molecular Formula | C14H12ClN3 |
| Molecular Weight | 257.07196 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 28.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.07196 Da |
| Heavy Atoms | 18 |
| Complexity | 293.0 |
| SMILES | C1C(N(N=N1)C2=CC=C(C=C2)Cl)C3=CC=CC=C3 |
| InChIKey | LBYGURSOGLWBQC-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole
Property Insights of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole
The XLogP value of 4.4 indicates that 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.0 Ų, 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole 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
What is the CAS number of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole?
The CAS number of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole is 114676-82-3.
What is the molecular formula of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole?
The molecular formula of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole is C14H12ClN3.
What is the molecular weight of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole?
The molecular weight of 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole is 257.07196 g/mol.
Where can I buy 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole?
You can request a quote for 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole?
Yes, CoreyChem provides custom synthesis services for 1-(4-Chlorophenyl)-5-phenyl-4,5-dihydro-1h-1,2,3-triazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.