3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine
TL;DR: 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine (CAS 956041-91-1) is a chemical compound with molecular formula C18H13ClN6O2 and molecular weight 380.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[5-methyl-2-(4-nitrophenyl)pyrazol-3-yl]quinoxalin-2-amine
Also Known As: 3-chloro-N-[5-methyl-2-(4-nitrophenyl)pyrazol-3-yl]quinoxalin-2-amine, (3-Chloro-quinoxalin-2-yl)-[5-methyl-2-(4-nitro-phenyl)-2H-pyrazol-3-yl]-amine, 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine, 3-chloro-N-[3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl]quinoxalin-2-amine
| Molecular Formula | C18H13ClN6O2 |
|---|---|
| Molecular Weight | 380.08 g/mol |
| LogP | 4.42912 |
| Topological Polar Surface Area | 98.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 380.07886 |
| Heavy Atoms | 27 |
| Complexity | 1156.4507 |
Chemical Identifiers
| CAS Number | 956041-91-1 |
|---|---|
| SMILES | CC1=NN(C(=C1)NC2=NC3=CC=CC=C3N=C2Cl)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine (CAS 956041-91-1), with molecular formula C18H13ClN6O2 and molecular weight 380.08 g/mol. IUPAC: 3-chloro-N-[5-methyl-2-(4-nitrophenyl)pyrazol-3-yl]quinoxalin-2-amine.
Chemical Property Profile of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine
Property Insights of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine
The XLogP value of 4.42912 indicates that 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine. Following Lipinski's Rule of Five, 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine has 1 hydrogen bond donor(s) and 6 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-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine?
The CAS number of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine is 956041-91-1.
What is the molecular formula of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine?
The molecular formula of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine is C18H13ClN6O2.
What is the molecular weight of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine?
The molecular weight of 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine is 380.08 g/mol.
Where can I buy 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine?
You can request a quote for 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(3-methyl-1-(4-nitrophenyl)-1H-pyrazol-5-yl)quinoxalin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.