Dichlobutrazol
TL;DR: Dichlobutrazol (CAS 84709-82-0) is a chemical compound with molecular formula C15H19Cl2N3O and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol
Also Known As: Dichlobutrazol, Vigilex, Dicyclobutrazole, Vigil, DICLOBUTRAZOL
| Molecular Formula | C15H19Cl2N3O |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 50.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 327.0905 |
| Heavy Atoms | 21 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 84709-82-0 |
|---|---|
| SMILES | CC(C)(C)[C@H]([C@@H](CC1=C(C=C(C=C1)Cl)Cl)N2C=NC=N2)O |
| InChIKey | URDNHJIVMYZFRT-KGLIPLIRSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dichlobutrazol (CAS 84709-82-0), with molecular formula C15H19Cl2N3O and molecular weight 327.09 g/mol. IUPAC: (2R,3R)-1-(2,4-dichlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol.
Chemical Property Profile of Dichlobutrazol
Property Insights of Dichlobutrazol
The XLogP value of 3.8 indicates that Dichlobutrazol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.9 Ų, Dichlobutrazol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dichlobutrazol has 1 hydrogen bond donor(s) and 3 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 Dichlobutrazol?
The CAS number of Dichlobutrazol is 84709-82-0.
What is the molecular formula of Dichlobutrazol?
The molecular formula of Dichlobutrazol is C15H19Cl2N3O.
What is the molecular weight of Dichlobutrazol?
The molecular weight of Dichlobutrazol is 327.09 g/mol.
Where can I buy Dichlobutrazol?
You can request a quote for Dichlobutrazol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichlobutrazol?
Yes, KEHONG BIO provides custom synthesis services for Dichlobutrazol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.