(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 849032-50-4) is a chemical compound with molecular formula C20H14N8O3S and molecular weight 446.09 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-(4-hydroxy-2-methylnaphthalen-1-yl)imino-5-thiophen-2-yltriazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-2-methyl-4-oxonaphthalen-1(4H)-ylidene]-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(2-methyl-4-oxonaphthalen-1-ylidene)amino]-5-thiophen-2-yltriazole-4-carboxamide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-methyl-4-oxonaphthalen-1-ylidene)amino]-5-thiophen-2-yltriazole-4-carboxamide
| Molecular Formula | C20H14N8O3S |
|---|---|
| Molecular Weight | 446.09 g/mol |
| LogP | 4.05232 |
| Topological Polar Surface Area | 157.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.09094 |
| Heavy Atoms | 32 |
| Complexity | 1486.332 |
Chemical Identifiers
| CAS Number | 849032-50-4 |
|---|---|
| SMILES | CC1=C(C2=CC=CC=C2C(=C1)O)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-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 849032-50-4), with molecular formula C20H14N8O3S and molecular weight 446.09 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-(4-hydroxy-2-methylnaphthalen-1-yl)imino-5-thiophen-2-yltriazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 4.05232 indicates that (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 157.67 Ų indicates high polarity, suggesting (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is 849032-50-4.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is C20H14N8O3S.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-5-(thiophen-2-yl)-1H-1,2,3-triazole-4-carbohydrazide is 446.09 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(2-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-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-methyl-4-oxonaphthalen-1(4H)-ylidene)-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.