(Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
TL;DR: (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 836644-53-2) is a chemical compound with molecular formula C16H19N9O2 and molecular weight 369.17 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-(anilinomethyl)-N-[(Z)-butan-2-ylideneamino]triazole-4-carboxamide
Also Known As: (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(Z)-butan-2-ylideneamino]triazole-4-carboxamide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(2Z)-butan-2-ylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C16H19N9O2 |
|---|---|
| Molecular Weight | 369.17 g/mol |
| LogP | 1.3603 |
| Topological Polar Surface Area | 149.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 369.16617 |
| Heavy Atoms | 27 |
| Complexity | 945.969 |
Chemical Identifiers
| CAS Number | 836644-53-2 |
|---|---|
| SMILES | CC/C(=N\NC(=O)C1=C(N(N=N1)C2=NON=C2N)CNC3=CC=CC=C3)/C |
Product Overview
(Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide (CAS 836644-53-2), with molecular formula C16H19N9O2 and molecular weight 369.17 g/mol. IUPAC: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(anilinomethyl)-N-[(Z)-butan-2-ylideneamino]triazole-4-carboxamide.
Chemical Property Profile of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
Property Insights of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide
The XLogP value of 1.3603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide. The TPSA of 149.14 Ų indicates high polarity, suggesting (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide has 3 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 (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The CAS number of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 836644-53-2.
What is the molecular formula of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular formula of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is C16H19N9O2.
What is the molecular weight of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
The molecular weight of (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide is 369.17 g/mol.
Where can I buy (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
You can request a quote for (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)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 (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-(butan-2-ylidene)-5-((phenylamino)methyl)-1H-1,2,3-triazole-4-carbohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.