1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole
TL;DR: 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole (CAS 72767-01-2) is a chemical compound with molecular formula C25H26ClN5O3 and molecular weight 479.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol;2-(furan-2-yl)-1H-benzimidazole
Also Known As: 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole, 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol; 2-(2-furyl)-1H-benzoimidazole, 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol; 2-(furan-2-yl)-1H-benzimidazole
| Molecular Formula | C25H26ClN5O3 |
|---|---|
| Molecular Weight | 479.17 g/mol |
| LogP | 5.739 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.17242 |
| Heavy Atoms | 34 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 72767-01-2 |
|---|---|
| SMILES | CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)Cl)O.C1=CC=C2C(=C1)NC(=N2)C3=CC=CO3 |
| InChIKey | ZMEUFAGEQXWMBW-UHFFFAOYSA-N |
Product Overview
1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole (CAS 72767-01-2), with molecular formula C25H26ClN5O3 and molecular weight 479.17 g/mol. IUPAC: 1-(4-chlorophenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-ol;2-(furan-2-yl)-1H-benzimidazole.
Chemical Property Profile of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole
Property Insights of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole
The XLogP value of 5.739 indicates that 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole. Following Lipinski's Rule of Five, 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole?
The CAS number of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole is 72767-01-2.
What is the molecular formula of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole?
The molecular formula of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole is C25H26ClN5O3.
What is the molecular weight of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole?
The molecular weight of 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole is 479.17 g/mol.
Where can I buy 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole?
You can request a quote for 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,4-Triazole-1-ethanol, beta-(4-chlorophenoxy)-alpha-(1,1-dimethylethyl)-, mixt. with 2-(2-furanyl)-1H-benzimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.