2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide
TL;DR: 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide (CAS 302333-65-9) is a chemical compound with molecular formula C20H20N6O4 and molecular weight 408.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)-N-[1-(4-nitrophenyl)ethylideneamino]acetamide
Also Known As: 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide, 2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)-N-[1-(4-nitrophenyl)ethylideneamino]acetamide
| Molecular Formula | C20H20N6O4 |
|---|---|
| Molecular Weight | 408.15 g/mol |
| LogP | 1.4693 |
| Topological Polar Surface Area | 138.09 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.1546 |
| Heavy Atoms | 30 |
| Complexity | 1001.71655 |
Chemical Identifiers
| CAS Number | 302333-65-9 |
|---|---|
| SMILES | CC(=NNC(=O)CC1C(=O)NNC(=N1)CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide (CAS 302333-65-9), with molecular formula C20H20N6O4 and molecular weight 408.15 g/mol. IUPAC: 2-(3-benzyl-6-oxo-2,5-dihydro-1H-1,2,4-triazin-5-yl)-N-[1-(4-nitrophenyl)ethylideneamino]acetamide.
Chemical Property Profile of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide
Property Insights of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide
The XLogP value of 1.4693 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide. The TPSA of 138.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide. Following Lipinski's Rule of Five, 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide has 3 hydrogen bond donor(s) and 7 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 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide?
The CAS number of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide is 302333-65-9.
What is the molecular formula of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide?
The molecular formula of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide is C20H20N6O4.
What is the molecular weight of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide?
The molecular weight of 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide is 408.15 g/mol.
Where can I buy 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide?
You can request a quote for 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-benzyl-6-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-5-yl)-N'-(1-(4-nitrophenyl)ethylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.