C21H19N9O7
TL;DR: C21H19N9O7 (CAS 577761-13-8) is a chemical compound with molecular formula C21H19N9O7 and molecular weight 509.14 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-nitrophenyl)-N-[(E)-(2,3,4-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-N'-(2,3,4-trimethoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C21H19N9O7 |
|---|---|
| Molecular Weight | 509.14 g/mol |
| LogP | 1.5974 |
| Topological Polar Surface Area | 207.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 9 |
| Exact Mass | 509.14075 |
| Heavy Atoms | 37 |
| Complexity | 1478.2626 |
Chemical Identifiers
| CAS Number | 577761-13-8 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)/C=N/NC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=C(C=C4)[N+](=O)[O-])OC)OC |
Product Overview
C21H19N9O7 (CAS 577761-13-8), with molecular formula C21H19N9O7 and molecular weight 509.14 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-N-[(E)-(2,3,4-trimethoxyphenyl)methylideneamino]triazole-4-carboxamide.
Chemical Property Profile of C21H19N9O7
Property Insights of C21H19N9O7
The XLogP value of 1.5974 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C21H19N9O7. The TPSA of 207.94 Ų indicates high polarity, suggesting C21H19N9O7 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C21H19N9O7 has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C21H19N9O7?
The CAS number of C21H19N9O7 is 577761-13-8.
What is the molecular formula of C21H19N9O7?
The molecular formula of C21H19N9O7 is C21H19N9O7.
What is the molecular weight of C21H19N9O7?
The molecular weight of C21H19N9O7 is 509.14 g/mol.
Where can I buy C21H19N9O7?
You can request a quote for C21H19N9O7 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C21H19N9O7?
Yes, KEHONG BIO provides custom synthesis services for C21H19N9O7 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.