F2696-0458
TL;DR: F2696-0458 (CAS 899758-63-5) is a chemical compound with molecular formula C20H18ClN3O3S and molecular weight 415.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-chloro-4-methoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-(2-methylphenyl)acetamide
Also Known As: F2696-0458, 2-((4-(3-chloro-4-methoxyphenyl)-3-oxo-3,4-dihydropyrazin-2-yl)thio)-N-(o-tolyl)acetamide, 2-[4-(3-chloro-4-methoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-(2-methylphenyl)acetamide, 2-{[4-(3-chloro-4-methoxyphenyl)-3-oxo-3,4-dihydropyrazin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
| Molecular Formula | C20H18ClN3O3S |
|---|---|
| Molecular Weight | 415.08 g/mol |
| LogP | 3.93372 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 415.07574 |
| Heavy Atoms | 28 |
| Complexity | 1068.5568 |
Chemical Identifiers
| CAS Number | 899758-63-5 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=NC=CN(C2=O)C3=CC(=C(C=C3)OC)Cl |
Product Overview
F2696-0458 (CAS 899758-63-5), with molecular formula C20H18ClN3O3S and molecular weight 415.08 g/mol. IUPAC: 2-[4-(3-chloro-4-methoxyphenyl)-3-oxopyrazin-2-yl]sulfanyl-N-(2-methylphenyl)acetamide.
Chemical Property Profile of F2696-0458
Property Insights of F2696-0458
The XLogP value of 3.93372 indicates that F2696-0458 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for F2696-0458. Following Lipinski's Rule of Five, F2696-0458 has 1 hydrogen bond donor(s) and 5 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 F2696-0458?
The CAS number of F2696-0458 is 899758-63-5.
What is the molecular formula of F2696-0458?
The molecular formula of F2696-0458 is C20H18ClN3O3S.
What is the molecular weight of F2696-0458?
The molecular weight of F2696-0458 is 415.08 g/mol.
Where can I buy F2696-0458?
You can request a quote for F2696-0458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2696-0458?
Yes, KEHONG BIO provides custom synthesis services for F2696-0458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.