N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide
TL;DR: N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide (CAS 301688-42-6) is a chemical compound with molecular formula C17H17ClN8O3 and molecular weight 416.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide
Also Known As: N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide, N-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide
| Molecular Formula | C17H17ClN8O3 |
|---|---|
| Molecular Weight | 416.11 g/mol |
| LogP | 0.55802 |
| Topological Polar Surface Area | 149.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 416.1112 |
| Heavy Atoms | 29 |
| Complexity | 1149.475 |
Chemical Identifiers
| CAS Number | 301688-42-6 |
|---|---|
| SMILES | CC1=NN(C(=C1C=NNC(=O)CCNC2=NNC(=O)NC2=O)Cl)C3=CC=CC=C3 |
Product Overview
N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide (CAS 301688-42-6), with molecular formula C17H17ClN8O3 and molecular weight 416.11 g/mol. IUPAC: N-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide.
Chemical Property Profile of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide
Property Insights of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide
The XLogP value of 0.55802 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide. The TPSA of 149.92 Ų indicates high polarity, suggesting N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide has 4 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 N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide?
The CAS number of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide is 301688-42-6.
What is the molecular formula of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide?
The molecular formula of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide is C17H17ClN8O3.
What is the molecular weight of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide?
The molecular weight of N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide is 416.11 g/mol.
Where can I buy N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide?
You can request a quote for N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide?
Yes, KEHONG BIO provides custom synthesis services for N'-((5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylene)-3-((5-hydroxy-3-oxo-2,3-dihydro-1,2,4-triazin-6-yl)amino)propanehydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.