2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate
TL;DR: 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate (CAS 81919-14-4) is a chemical compound with molecular formula C22H28N4O5 and molecular weight 428.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate
Also Known As: Bendalina, Bendaline, Bendazac lysine, Bendazac L-lysine, Bendazaco lisina [Spanish]
| Molecular Formula | C22H28N4O5 |
|---|---|
| Molecular Weight | 428.21 g/mol |
| LogP | -2.03 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 428.20596 |
| Heavy Atoms | 31 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 81919-14-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=N2)OCC(=O)[O-].C(CC[NH3+])CC(C(=O)[O-])[NH3+] |
| InChIKey | OCOCFNMFLNFNIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate (CAS 81919-14-4), with molecular formula C22H28N4O5 and molecular weight 428.21 g/mol. IUPAC: 2-(1-benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate.
Chemical Property Profile of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate
Property Insights of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate
The XLogP value of -2.03 indicates that 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 163.0 Ų indicates high polarity, suggesting 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate 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-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate?
The CAS number of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate is 81919-14-4.
What is the molecular formula of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate?
The molecular formula of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate is C22H28N4O5.
What is the molecular weight of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate?
The molecular weight of 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate is 428.21 g/mol.
Where can I buy 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate?
You can request a quote for 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Benzylindazol-3-yl)oxyacetate;2,6-bis(azaniumyl)hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.