3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide
TL;DR: 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide (CAS 690686-23-8) is a chemical compound with molecular formula C17H13ClN2O2 and molecular weight 312.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-3-methyl-4-oxido-6-phenylpyrazin-1-ium 1-oxide
Also Known As: 3-(4-chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide, AB00652356-06, 3-(4-Chloro-phenyl)-2-methyl-5-phenyl-pyrazine 1,4-dioxide, 2-(4-chlorophenyl)-3-methyl-4-oxido-6-phenylpyrazin-1-ium 1-oxide
| Molecular Formula | C17H13ClN2O2 |
|---|---|
| Molecular Weight | 312.07 g/mol |
| LogP | 4.04432 |
| Topological Polar Surface Area | 50.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.06656 |
| Heavy Atoms | 22 |
| Complexity | 871.65594 |
Chemical Identifiers
| CAS Number | 690686-23-8 |
|---|---|
| SMILES | CC1=C([N+](=O)C(=CN1[O-])C2=CC=CC=C2)C3=CC=C(C=C3)Cl |
Product Overview
3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide (CAS 690686-23-8), with molecular formula C17H13ClN2O2 and molecular weight 312.07 g/mol. IUPAC: 2-(4-chlorophenyl)-3-methyl-4-oxido-6-phenylpyrazin-1-ium 1-oxide.
Chemical Property Profile of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide
Property Insights of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide
The XLogP value of 4.04432 indicates that 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.96 Ų, 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide has 0 hydrogen bond donor(s) and 2 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-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide?
The CAS number of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide is 690686-23-8.
What is the molecular formula of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide?
The molecular formula of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide is C17H13ClN2O2.
What is the molecular weight of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide?
The molecular weight of 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide is 312.07 g/mol.
Where can I buy 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide?
You can request a quote for 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-2-methyl-5-phenylpyrazine 1,4-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.