(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide (CAS 488745-35-3) is a chemical compound with molecular formula C14H12Cl2N8O3 and molecular weight 410.04 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)-(3,5-dichloro-2-methoxyphenyl)methylideneamino]-5-methyltriazole-4-carboxamide
Also Known As: (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]-5-methyl-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(3,5-dichloro-2-methoxyphenyl)methylideneamino]-5-methyltriazole-4-carboxamide
| Molecular Formula | C14H12Cl2N8O3 |
|---|---|
| Molecular Weight | 410.04 g/mol |
| LogP | 1.62022 |
| Topological Polar Surface Area | 146.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.04095 |
| Heavy Atoms | 27 |
| Complexity | 1029.5416 |
Chemical Identifiers
| CAS Number | 488745-35-3 |
|---|---|
| SMILES | CC1=C(N=NN1C2=NON=C2N)C(=O)N/N=C/C3=C(C(=CC(=C3)Cl)Cl)OC |
Product Overview
(E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide (CAS 488745-35-3), with molecular formula C14H12Cl2N8O3 and molecular weight 410.04 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(3,5-dichloro-2-methoxyphenyl)methylideneamino]-5-methyltriazole-4-carboxamide.
Chemical Property Profile of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 1.62022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-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'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-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'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide has 2 hydrogen bond donor(s) and 9 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'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide is 488745-35-3.
What is the molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide is C14H12Cl2N8O3.
What is the molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide is 410.04 g/mol.
Where can I buy (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-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'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-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'-(3,5-dichloro-2-methoxybenzylidene)-5-methyl-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.