Loxtidine
TL;DR: Loxtidine (CAS 76956-02-0) is a chemical compound with molecular formula C19H29N5O2 and molecular weight 359.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-methyl-5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1,2,4-triazol-3-yl]methanol
Also Known As: Loxtidine, LAVOLTIDINE, Lavoltidina, Loxtidinum, Loxtidina
| Molecular Formula | C19H29N5O2 |
|---|---|
| Molecular Weight | 359.23 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 359.23212 |
| Heavy Atoms | 26 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 76956-02-0 |
|---|---|
| SMILES | CN1C(=NC(=N1)CO)NCCCOC2=CC=CC(=C2)CN3CCCCC3 |
| InChIKey | VTLNPNNUIJHJQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Loxtidine (CAS 76956-02-0), with molecular formula C19H29N5O2 and molecular weight 359.23 g/mol. IUPAC: [1-methyl-5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1,2,4-triazol-3-yl]methanol.
Chemical Property Profile of Loxtidine
Property Insights of Loxtidine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Loxtidine. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Loxtidine. Following Lipinski's Rule of Five, Loxtidine 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 Loxtidine?
The CAS number of Loxtidine is 76956-02-0.
What is the molecular formula of Loxtidine?
The molecular formula of Loxtidine is C19H29N5O2.
What is the molecular weight of Loxtidine?
The molecular weight of Loxtidine is 359.23 g/mol.
Where can I buy Loxtidine?
You can request a quote for Loxtidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Loxtidine?
Yes, KEHONG BIO provides custom synthesis services for Loxtidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.