(3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine
TL;DR: (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine (CAS 482573-93-3) is a chemical compound with molecular formula C16H12N6O6 and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-phenyl-N-(2,4,6-trinitrophenyl)pyrazol-3-amine
Also Known As: 5-methyl-2-phenyl-N-(2,4,6-trinitrophenyl)pyrazol-3-amine, 3-Methyl-1-phenyl-N-(2,4,6-trinitrophenyl)-1H-pyrazol-5-amine, (3-methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine
| Molecular Formula | C16H12N6O6 |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 3.64892 |
| Topological Polar Surface Area | 159.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.08182 |
| Heavy Atoms | 28 |
| Complexity | 1059.2542 |
Chemical Identifiers
| CAS Number | 482573-93-3 |
|---|---|
| SMILES | CC1=NN(C(=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3 |
Product Overview
(3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine (CAS 482573-93-3), with molecular formula C16H12N6O6 and molecular weight 384.08 g/mol. IUPAC: 5-methyl-2-phenyl-N-(2,4,6-trinitrophenyl)pyrazol-3-amine.
Chemical Property Profile of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine
Property Insights of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine
The XLogP value of 3.64892 indicates that (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 159.27 Ų indicates high polarity, suggesting (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine has 1 hydrogen bond donor(s) and 8 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 (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine?
The CAS number of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine is 482573-93-3.
What is the molecular formula of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine?
The molecular formula of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine is C16H12N6O6.
What is the molecular weight of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine?
The molecular weight of (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine is 384.08 g/mol.
Where can I buy (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine?
You can request a quote for (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine?
Yes, KEHONG BIO provides custom synthesis services for (3-Methyl-1-phenylpyrazol-5-yl)(2,4,6-trinitrophenyl)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.