![1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine structure](/static/products/313/313273-16-4.png)
1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine
TL;DR: 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine (CAS 313273-16-4) is a chemical compound with molecular formula C16H17N7O3 and molecular weight 355.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine
Also Known As: 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine, N-(3-((3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl)-4-methoxybenzylidene)-4H-1,2,4-triazol-3-amine
| Molecular Formula | C16H17N7O3 |
|---|---|
| Molecular Weight | 355.14 g/mol |
| LogP | 2.33374 |
| Topological Polar Surface Area | 124.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.13928 |
| Heavy Atoms | 26 |
| Complexity | 960.6362 |
Chemical Identifiers
| CAS Number | 313273-16-4 |
|---|---|
| SMILES | CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NC3=NC=NN3)OC)C)[N+](=O)[O-] |
Product Overview
1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine (CAS 313273-16-4), with molecular formula C16H17N7O3 and molecular weight 355.14 g/mol. IUPAC: 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine.
Chemical Property Profile of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine
Property Insights of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine
The XLogP value of 2.33374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine. The TPSA of 124.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine. Following Lipinski's Rule of Five, 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine has 1 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 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine?
The CAS number of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine is 313273-16-4.
What is the molecular formula of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine?
The molecular formula of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine is C16H17N7O3.
What is the molecular weight of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine?
The molecular weight of 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine is 355.14 g/mol.
Where can I buy 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine?
You can request a quote for 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]-N-(1H-1,2,4-triazol-5-yl)methanimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.