PROPICONAZOLE
TL;DR: PROPICONAZOLE (CAS 116498-43-2) is a chemical compound with molecular formula C15H17Cl2N3O2 and molecular weight 341.0698 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole
Also Known As: PROPICONAZOLE, (2S,4R)-Propiconazole, 1-{[(2S,4R)-2-(2,4-Dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl}-1H-1,2,4-triazole, 1-[[(2S,4R)-2-(2,4-dichlorophenyl)-4-propyl-1,3-dioxolan-2-yl]methyl]-1,2,4-triazole, (2S,4R)-2-(2,4-Dichlorophenyl)-4-propyl-2-[(1H-1,2,4-triazol-1-yl)methyl]-1,3-dioxolane
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H17Cl2N3O2 |
| Molecular Weight | 341.0698 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 49.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.0698 Da |
| Heavy Atoms | 22 |
| Complexity | 377.0 |
| SMILES | CCC[C@@H]1CO[C@@](O1)(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl |
| InChIKey | STJLVHWMYQXCPB-IUODEOHRSA-N |
Chemical Property Profile of PROPICONAZOLE
Property Insights of PROPICONAZOLE
The XLogP value of 3.5 indicates that PROPICONAZOLE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.2 Ų, PROPICONAZOLE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, PROPICONAZOLE 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
What is the CAS number of PROPICONAZOLE?
The CAS number of PROPICONAZOLE is 116498-43-2.
What is the molecular formula of PROPICONAZOLE?
The molecular formula of PROPICONAZOLE is C15H17Cl2N3O2.
What is the molecular weight of PROPICONAZOLE?
The molecular weight of PROPICONAZOLE is 341.0698 g/mol.
Where can I buy PROPICONAZOLE?
You can request a quote for PROPICONAZOLE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for PROPICONAZOLE?
Yes, CoreyChem provides custom synthesis services for PROPICONAZOLE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.