VU0511538-1
TL;DR: VU0511538-1 (CAS 895107-75-2) is a chemical compound with molecular formula C21H20ClN3O2S and molecular weight 413.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-chlorophenyl)methyl]-2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide
Also Known As: VU0511538-1, F3165-1650, N-[(2-chlorophenyl)methyl]-2-{[4-(3,5-dimethylphenyl)-3-oxo-3,4-dihydropyrazin-2-yl]sulfanyl}acetamide, N-(2-chlorobenzyl)-2-((4-(3,5-dimethylphenyl)-3-oxo-3,4-dihydropyrazin-2-yl)thio)acetamide, N-[(2-chlorophenyl)methyl]-2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide
| Molecular Formula | C21H20ClN3O2S |
|---|---|
| Molecular Weight | 413.10 g/mol |
| LogP | 3.91124 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.09647 |
| Heavy Atoms | 28 |
| Complexity | 1045.2615 |
Chemical Identifiers
| CAS Number | 895107-75-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C=CN=C(C2=O)SCC(=O)NCC3=CC=CC=C3Cl)C |
Product Overview
VU0511538-1 (CAS 895107-75-2), with molecular formula C21H20ClN3O2S and molecular weight 413.10 g/mol. IUPAC: N-[(2-chlorophenyl)methyl]-2-[4-(3,5-dimethylphenyl)-3-oxopyrazin-2-yl]sulfanylacetamide.
Chemical Property Profile of VU0511538-1
Property Insights of VU0511538-1
The XLogP value of 3.91124 indicates that VU0511538-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0511538-1. Following Lipinski's Rule of Five, VU0511538-1 has 1 hydrogen bond donor(s) and 4 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 VU0511538-1?
The CAS number of VU0511538-1 is 895107-75-2.
What is the molecular formula of VU0511538-1?
The molecular formula of VU0511538-1 is C21H20ClN3O2S.
What is the molecular weight of VU0511538-1?
The molecular weight of VU0511538-1 is 413.10 g/mol.
Where can I buy VU0511538-1?
You can request a quote for VU0511538-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0511538-1?
Yes, KEHONG BIO provides custom synthesis services for VU0511538-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.