C22H22N8O6
TL;DR: C22H22N8O6 (CAS 861629-63-2) is a chemical compound with molecular formula C22H22N8O6 and molecular weight 494.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N-[(E)-(2,3,4-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-(2,3,4-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C22H22N8O6 |
|---|---|
| Molecular Weight | 494.17 g/mol |
| LogP | 1.6978 |
| Topological Polar Surface Area | 174.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 494.16623 |
| Heavy Atoms | 36 |
| Complexity | 1413.5417 |
Chemical Identifiers
| CAS Number | 861629-63-2 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)/C=N/NC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC(=CC=C4)OC)OC)OC |
Product Overview
C22H22N8O6 (CAS 861629-63-2), with molecular formula C22H22N8O6 and molecular weight 494.17 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N-[(E)-(2,3,4-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide.
Chemical Property Profile of C22H22N8O6
Property Insights of C22H22N8O6
The XLogP value of 1.6978 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C22H22N8O6. The TPSA of 174.03 Ų indicates high polarity, suggesting C22H22N8O6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C22H22N8O6 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C22H22N8O6?
The CAS number of C22H22N8O6 is 861629-63-2.
What is the molecular formula of C22H22N8O6?
The molecular formula of C22H22N8O6 is C22H22N8O6.
What is the molecular weight of C22H22N8O6?
The molecular weight of C22H22N8O6 is 494.17 g/mol.
Where can I buy C22H22N8O6?
You can request a quote for C22H22N8O6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H22N8O6?
Yes, KEHONG BIO provides custom synthesis services for C22H22N8O6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.