6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)
TL;DR: 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) (CAS 63816-06-8) is a chemical compound with molecular formula C35H30Cl2N6O5 and molecular weight 684.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(6-chloro-1,3-diphenyl-2H-imidazo[4,5-b]quinoxalin-2-yl)ethenyl]-1-ethyl-5-methyl-2-phenylpyrazol-3-one;perchloric acid
Also Known As: 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)
| Molecular Formula | C35H30Cl2N6O5 |
|---|---|
| Molecular Weight | 684.17 g/mol |
| LogP | 3.76922 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 684.16547 |
| Heavy Atoms | 48 |
| Complexity | 1160.0 |
Chemical Identifiers
| CAS Number | 63816-06-8 |
|---|---|
| SMILES | CCN1C(=C(C(=O)N1C2=CC=CC=C2)C=CC3N(C4=NC5=C(C=C(C=C5)Cl)N=C4N3C6=CC=CC=C6)C7=CC=CC=C7)C.OCl(=O)(=O)=O |
| InChIKey | CXKNWSPBCJLKBW-UHFFFAOYSA-N |
Product Overview
6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) (CAS 63816-06-8), with molecular formula C35H30Cl2N6O5 and molecular weight 684.17 g/mol. IUPAC: 4-[2-(6-chloro-1,3-diphenyl-2H-imidazo[4,5-b]quinoxalin-2-yl)ethenyl]-1-ethyl-5-methyl-2-phenylpyrazol-3-one;perchloric acid.
Chemical Property Profile of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)
Property Insights of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)
The XLogP value of 3.76922 indicates that 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1). Following Lipinski's Rule of Five, 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)?
The CAS number of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) is 63816-06-8.
What is the molecular formula of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)?
The molecular formula of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) is C35H30Cl2N6O5.
What is the molecular weight of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)?
The molecular weight of 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) is 684.17 g/mol.
Where can I buy 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)?
You can request a quote for 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-2-[2-(1-ethyl-2,3-dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)ethenyl]-1,3-diphenyl-1H-imidazo[4,5-b]quinoxalinium perchlorate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.