VU0509444-1
TL;DR: VU0509444-1 (CAS 852696-88-9) is a chemical compound with molecular formula C21H22N4O2S2 and molecular weight 426.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
Also Known As: VU0509444-1, 2-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl}-1-[4-(pyridin-2-yl)piperazin-1-yl]ethan-1-one, F3116-0074, 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone, 2-{[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl}-1-[4-(pyridin-2-yl)piperazin-1-yl]ethanone
| Molecular Formula | C21H22N4O2S2 |
|---|---|
| Molecular Weight | 426.12 g/mol |
| LogP | 3.6546 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.1184 |
| Heavy Atoms | 29 |
| Complexity | 938.82965 |
Chemical Identifiers
| CAS Number | 852696-88-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)N3CCN(CC3)C4=CC=CC=N4 |
Product Overview
VU0509444-1 (CAS 852696-88-9), with molecular formula C21H22N4O2S2 and molecular weight 426.12 g/mol. IUPAC: 2-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]sulfanyl]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone.
Chemical Property Profile of VU0509444-1
Property Insights of VU0509444-1
The XLogP value of 3.6546 indicates that VU0509444-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.56 Ų, VU0509444-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0509444-1 has 0 hydrogen bond donor(s) and 7 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 VU0509444-1?
The CAS number of VU0509444-1 is 852696-88-9.
What is the molecular formula of VU0509444-1?
The molecular formula of VU0509444-1 is C21H22N4O2S2.
What is the molecular weight of VU0509444-1?
The molecular weight of VU0509444-1 is 426.12 g/mol.
Where can I buy VU0509444-1?
You can request a quote for VU0509444-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0509444-1?
Yes, KEHONG BIO provides custom synthesis services for VU0509444-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.