VU0235619-3
TL;DR: VU0235619-3 (CAS 690961-57-0) is a chemical compound with molecular formula C19H15N3O2S and molecular weight 349.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-6-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline
Also Known As: VU0235619-3, 1-{[(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]sulfanyl}-[1,2,4]triazolo[4,3-a]quinoline, 1-(((2,3-dihydrobenzo[b][1,4]dioxin-6-yl)methyl)thio)-[1,2,4]triazolo[4,3-a]quinoline, 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline, 3-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylthio]-2,4,5-triazatricyclo[7.4.0.0(2),]trideca-1(9),3,5,7,10,12-hexaene
| Molecular Formula | C19H15N3O2S |
|---|---|
| Molecular Weight | 349.09 g/mol |
| LogP | 3.946 |
| Topological Polar Surface Area | 48.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.0885 |
| Heavy Atoms | 25 |
| Complexity | 1076.842 |
Chemical Identifiers
| CAS Number | 690961-57-0 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)CSC3=NN=C4N3C5=CC=CC=C5C=C4 |
Product Overview
VU0235619-3 (CAS 690961-57-0), with molecular formula C19H15N3O2S and molecular weight 349.09 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-6-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinoline.
Chemical Property Profile of VU0235619-3
Property Insights of VU0235619-3
The XLogP value of 3.946 indicates that VU0235619-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.65 Ų, VU0235619-3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0235619-3 has 0 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 VU0235619-3?
The CAS number of VU0235619-3 is 690961-57-0.
What is the molecular formula of VU0235619-3?
The molecular formula of VU0235619-3 is C19H15N3O2S.
What is the molecular weight of VU0235619-3?
The molecular weight of VU0235619-3 is 349.09 g/mol.
Where can I buy VU0235619-3?
You can request a quote for VU0235619-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0235619-3?
Yes, KEHONG BIO provides custom synthesis services for VU0235619-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.