RefChem:424646
TL;DR: RefChem:424646 (CAS 478250-96-3) is a chemical compound with molecular formula C26H20Cl2N8O4 and molecular weight 578.10 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)-[4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-5-phenyltriazole-4-carboxamide
Also Known As: 1-(4-AMINO-1,2,5-OXADIAZOL-3-YL)-N'-((E)-{4-[(2,4-DICHLOROBENZYL)OXY]-3-METHOXYPHENYL}METHYLIDENE)-4-PHENYL-1H-1,2,3-TRIAZOLE-5-CARBOHYDRAZIDE, 1-(4-Amino-1,2,5-oxadiazol-3-YL)-N'-((E)-(4-((2,4-dichlorobenzyl)oxy)-3-methoxyphenyl)methylidene)-4-phenyl-1H-1,2,3-triazole-5-carbohydrazide, 632-410-6, RefChem:424646
| Molecular Formula | C26H20Cl2N8O4 |
|---|---|
| Molecular Weight | 578.10 g/mol |
| LogP | 4.5578 |
| Topological Polar Surface Area | 155.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 578.09845 |
| Heavy Atoms | 40 |
| Complexity | 1687.5502 |
Chemical Identifiers
| CAS Number | 478250-96-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=N/NC(=O)C2=C(N=NN2C3=NON=C3N)C4=CC=CC=C4)OCC5=C(C=C(C=C5)Cl)Cl |
Product Overview
RefChem:424646 (CAS 478250-96-3), with molecular formula C26H20Cl2N8O4 and molecular weight 578.10 g/mol. IUPAC: 3-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-[4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-5-phenyltriazole-4-carboxamide.
Chemical Property Profile of RefChem:424646
Property Insights of RefChem:424646
The XLogP value of 4.5578 indicates that RefChem:424646 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.57 Ų indicates high polarity, suggesting RefChem:424646 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:424646 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:424646?
The CAS number of RefChem:424646 is 478250-96-3.
What is the molecular formula of RefChem:424646?
The molecular formula of RefChem:424646 is C26H20Cl2N8O4.
What is the molecular weight of RefChem:424646?
The molecular weight of RefChem:424646 is 578.10 g/mol.
Where can I buy RefChem:424646?
You can request a quote for RefChem:424646 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:424646?
Yes, KEHONG BIO provides custom synthesis services for RefChem:424646 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.