2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone
TL;DR: 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone (CAS 98296-23-2) is a chemical compound with molecular formula C18H26N4O3 and molecular weight 346.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-hydroxy-3-propyl-4-[6-(2H-tetrazol-5-yl)hexoxy]phenyl]ethanone
Also Known As: 4-THA, KST-1B9519, 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone, 1-(2-hydroxy-3-propyl-4-{[6-(2h-tetrazol-5-yl)hexyl]oxy}phenyl)ethanone, Ethanone, 1-(2-hydroxy-3-propyl-4-((6-(1H-tetrazol-5-yl)hexyl)oxy)phenyl)-
| Molecular Formula | C18H26N4O3 |
|---|---|
| Molecular Weight | 346.20 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 346.2005 |
| Heavy Atoms | 25 |
| Complexity | 397.0 |
Chemical Identifiers
| CAS Number | 98296-23-2 |
|---|---|
| SMILES | CCCC1=C(C=CC(=C1O)C(=O)C)OCCCCCCC2=NNN=N2 |
| InChIKey | WOXRHRBPWQWPSP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone (CAS 98296-23-2), with molecular formula C18H26N4O3 and molecular weight 346.20 g/mol. IUPAC: 1-[2-hydroxy-3-propyl-4-[6-(2H-tetrazol-5-yl)hexoxy]phenyl]ethanone.
Chemical Property Profile of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone
Property Insights of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone
The XLogP value of 4.6 indicates that 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone. Following Lipinski's Rule of Five, 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone has 2 hydrogen bond donor(s) and 6 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 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone?
The CAS number of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone is 98296-23-2.
What is the molecular formula of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone?
The molecular formula of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone is C18H26N4O3.
What is the molecular weight of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone?
The molecular weight of 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone is 346.20 g/mol.
Where can I buy 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone?
You can request a quote for 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-3-propyl-4-(6-(tetrazol-5-yl)hexyloxy)acetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.