1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol
TL;DR: 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol (CAS 959360-34-0) is a chemical compound with molecular formula C10H10ClN3O and molecular weight 223.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
Also Known As: 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol, 1-p-chlorophenyl-2-(1,2,4-triazol-1-yl)ethanol, 1-(4-Chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol, 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanol, 1-p-chlorophenyl-2-(1,2,4-triazol-1-yl)-ethanol
| Molecular Formula | C10H10ClN3O |
|---|---|
| Molecular Weight | 223.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 50.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.05124 |
| Heavy Atoms | 15 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 959360-34-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C(CN2C=NC=N2)O)Cl |
| InChIKey | GANDFHBWHQFNCX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol (CAS 959360-34-0), with molecular formula C10H10ClN3O and molecular weight 223.05 g/mol. IUPAC: 1-(4-chlorophenyl)-2-(1,2,4-triazol-1-yl)ethanol.
Chemical Property Profile of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol
Property Insights of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol. With a topological polar surface area (TPSA) of 50.9 Ų, 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol 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 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol?
The CAS number of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol is 959360-34-0.
What is the molecular formula of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol?
The molecular formula of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol is C10H10ClN3O.
What is the molecular weight of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol?
The molecular weight of 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol is 223.05 g/mol.
Where can I buy 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol?
You can request a quote for 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.