C20H17N9O5
TL;DR: C20H17N9O5 (CAS 573698-05-2) is a chemical compound with molecular formula C20H17N9O5 and molecular weight 463.14 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-(4-ethoxyphenyl)-N-[(E)-(2-nitrophenyl)methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-(2-nitrobenzylidene)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N'-[(E)-(2-nitrophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C20H17N9O5 |
|---|---|
| Molecular Weight | 463.14 g/mol |
| LogP | 1.9703 |
| Topological Polar Surface Area | 189.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 463.13525 |
| Heavy Atoms | 34 |
| Complexity | 1361.0289 |
Chemical Identifiers
| CAS Number | 573698-05-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=CC=C4[N+](=O)[O-] |
Product Overview
C20H17N9O5 (CAS 573698-05-2), with molecular formula C20H17N9O5 and molecular weight 463.14 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-ethoxyphenyl)-N-[(E)-(2-nitrophenyl)methylideneamino]triazole-4-carboxamide.
Chemical Property Profile of C20H17N9O5
Property Insights of C20H17N9O5
The XLogP value of 1.9703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C20H17N9O5. The TPSA of 189.48 Ų indicates high polarity, suggesting C20H17N9O5 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C20H17N9O5 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C20H17N9O5?
The CAS number of C20H17N9O5 is 573698-05-2.
What is the molecular formula of C20H17N9O5?
The molecular formula of C20H17N9O5 is C20H17N9O5.
What is the molecular weight of C20H17N9O5?
The molecular weight of C20H17N9O5 is 463.14 g/mol.
Where can I buy C20H17N9O5?
You can request a quote for C20H17N9O5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C20H17N9O5?
Yes, KEHONG BIO provides custom synthesis services for C20H17N9O5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.