RefChem:424696
TL;DR: RefChem:424696 (CAS 478250-99-6) is a chemical compound with molecular formula C26H21ClN8O3 and molecular weight 528.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-1-[4-[(2-chlorophenyl)methoxy]phenyl]ethylideneamino]-5-phenyltriazole-4-carboxamide
Also Known As: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-1-{4-[(2-chlorobenzyl)oxy]phenyl}ethylidene)-4-phenyl-1H-1,2,3-triazole-5-carbohydrazide, 1-(4-Amino-1,2,5-oxadiazol-3-YL)-N'-((E)-1-(4-((2-chlorobenzyl)oxy)phenyl)ethylidene)-4-phenyl-1H-1,2,3-triazole-5-carbohydrazide, 631-827-0, RefChem:424696
| Molecular Formula | C26H21ClN8O3 |
|---|---|
| Molecular Weight | 528.14 g/mol |
| LogP | 4.2859 |
| Topological Polar Surface Area | 146.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 528.1425 |
| Heavy Atoms | 38 |
| Complexity | 1596.565 |
Chemical Identifiers
| CAS Number | 478250-99-6 |
|---|---|
| SMILES | C/C(=N\NC(=O)C1=C(N=NN1C2=NON=C2N)C3=CC=CC=C3)/C4=CC=C(C=C4)OCC5=CC=CC=C5Cl |
Product Overview
RefChem:424696 (CAS 478250-99-6), with molecular formula C26H21ClN8O3 and molecular weight 528.14 g/mol. IUPAC: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-1-[4-[(2-chlorophenyl)methoxy]phenyl]ethylideneamino]-5-phenyltriazole-4-carboxamide.
Chemical Property Profile of RefChem:424696
Property Insights of RefChem:424696
The XLogP value of 4.2859 indicates that RefChem:424696 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.34 Ų indicates high polarity, suggesting RefChem:424696 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:424696 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:424696?
The CAS number of RefChem:424696 is 478250-99-6.
What is the molecular formula of RefChem:424696?
The molecular formula of RefChem:424696 is C26H21ClN8O3.
What is the molecular weight of RefChem:424696?
The molecular weight of RefChem:424696 is 528.14 g/mol.
Where can I buy RefChem:424696?
You can request a quote for RefChem:424696 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:424696?
Yes, KEHONG BIO provides custom synthesis services for RefChem:424696 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.