Agelenotoxin 505
TL;DR: Agelenotoxin 505 (CAS 128549-97-3) is a chemical compound with molecular formula C26H47N7O3 and molecular weight 505.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[3-[3-[4-(3-aminopropylamino)butylamino]propylamino]propyl-hydroxyamino]propyl]-2-(4-hydroxy-1H-indol-3-yl)acetamide
Also Known As: Agelenotoxin 505, alpha-Agatoxin AG 505, NPS 015, 1H-Indole-3-acetamide, N-(20-amino-4-hydroxy-4,8,12,17-tetraazaeicos-1-yl)-4-hydroxy-, N-(20-Amino-4-hydroxy-4,8,12,17-tetraazaicosan-1-yl)-4-hydroxy-1H-indole-3-acetamide
| Molecular Formula | C26H47N7O3 |
|---|---|
| Molecular Weight | 505.37 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 22 |
| Exact Mass | 505.37402 |
| Heavy Atoms | 36 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 128549-97-3 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)O)C(=CN2)CC(=O)NCCCN(CCCNCCCNCCCCNCCCN)O |
| InChIKey | JLYKHRGGJINZBF-UHFFFAOYSA-N |
Product Overview
Agelenotoxin 505 (CAS 128549-97-3), with molecular formula C26H47N7O3 and molecular weight 505.37 g/mol. IUPAC: N-[3-[3-[3-[4-(3-aminopropylamino)butylamino]propylamino]propyl-hydroxyamino]propyl]-2-(4-hydroxy-1H-indol-3-yl)acetamide.
Chemical Property Profile of Agelenotoxin 505
Property Insights of Agelenotoxin 505
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Agelenotoxin 505. The TPSA of 151.0 Ų indicates high polarity, suggesting Agelenotoxin 505 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Agelenotoxin 505 has 8 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Agelenotoxin 505?
The CAS number of Agelenotoxin 505 is 128549-97-3.
What is the molecular formula of Agelenotoxin 505?
The molecular formula of Agelenotoxin 505 is C26H47N7O3.
What is the molecular weight of Agelenotoxin 505?
The molecular weight of Agelenotoxin 505 is 505.37 g/mol.
Where can I buy Agelenotoxin 505?
You can request a quote for Agelenotoxin 505 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Agelenotoxin 505?
Yes, KEHONG BIO provides custom synthesis services for Agelenotoxin 505 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.