(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 862129-39-3) is a chemical compound with molecular formula C21H16N8O3S and molecular weight 460.11 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)-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-5-thiophen-2-yltriazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-methoxynaphthalen-1-yl)methylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-5-thiophen-2-yltriazole-4-carboxamide
| Molecular Formula | C21H16N8O3S |
|---|---|
| Molecular Weight | 460.11 g/mol |
| LogP | 2.8867 |
| Topological Polar Surface Area | 146.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.1066 |
| Heavy Atoms | 33 |
| Complexity | 1472.2389 |
Chemical Identifiers
| CAS Number | 862129-39-3 |
|---|---|
| SMILES | COC1=C(C2=CC=CC=C2C=C1)/C=N/NC(=O)C3=C(N(N=N3)C4=NON=C4N)C5=CC=CS5 |
Product Overview
(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 862129-39-3), with molecular formula C21H16N8O3S and molecular weight 460.11 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-methoxynaphthalen-1-yl)methylideneamino]-5-thiophen-2-yltriazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 2.8867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide. The TPSA of 146.34 Ų indicates high polarity, suggesting (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is 862129-39-3.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is C21H16N8O3S.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is 460.11 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((2-methoxynaphthalen-1-yl)methylene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.