5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one
TL;DR: 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one (CAS 87486-40-6) is a chemical compound with molecular formula C6H7ClN2O2 and molecular weight 174.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-methoxy-1-methylpyrazin-2-one
Also Known As: 5-chloro-3-methoxy-1-methylpyrazin-2-one, 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one, 5-chloro-3-methoxy-1-methyl-pyrazin-2-one, 5-Chloro-3-methoxy-1-methyl-2(1H)-pyrazinone, RefChem:302510
| Molecular Formula | C6H7ClN2O2 |
|---|---|
| Molecular Weight | 174.02 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0196 |
| Heavy Atoms | 11 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 87486-40-6 |
|---|---|
| SMILES | CN1C=C(N=C(C1=O)OC)Cl |
| InChIKey | RZLYFRLUERXWDX-UHFFFAOYSA-N |
Product Overview
5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one (CAS 87486-40-6), with molecular formula C6H7ClN2O2 and molecular weight 174.02 g/mol. IUPAC: 5-chloro-3-methoxy-1-methylpyrazin-2-one.
Chemical Property Profile of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one
Property Insights of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one. With a topological polar surface area (TPSA) of 41.9 Ų, 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one has 0 hydrogen bond donor(s) and 3 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 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one?
The CAS number of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one is 87486-40-6.
What is the molecular formula of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one?
The molecular formula of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one is C6H7ClN2O2.
What is the molecular weight of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one?
The molecular weight of 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one is 174.02 g/mol.
Where can I buy 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one?
You can request a quote for 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-3-methoxy-1-methylpyrazin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.