VU0618410-1
TL;DR: VU0618410-1 (CAS 690647-07-5) is a chemical compound with molecular formula C20H18FN5O2S and molecular weight 411.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone
Also Known As: VU0618410-1, F3394-1189, AQ-750/42502510, 2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)-1-(4-(5-fluorobenzo[d]isoxazol-3-yl)piperidin-1-yl)ethanone, 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone
| Molecular Formula | C20H18FN5O2S |
|---|---|
| Molecular Weight | 411.12 g/mol |
| LogP | 3.5079 |
| Topological Polar Surface Area | 76.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 411.11652 |
| Heavy Atoms | 29 |
| Complexity | 1182.0243 |
Chemical Identifiers
| CAS Number | 690647-07-5 |
|---|---|
| SMILES | C1CN(CCC1C2=NOC3=C2C=C(C=C3)F)C(=O)CSC4=NN=C5N4C=CC=C5 |
Product Overview
VU0618410-1 (CAS 690647-07-5), with molecular formula C20H18FN5O2S and molecular weight 411.12 g/mol. IUPAC: 1-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylsulfanyl)ethanone.
Chemical Property Profile of VU0618410-1
Property Insights of VU0618410-1
The XLogP value of 3.5079 indicates that VU0618410-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.53 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0618410-1. Following Lipinski's Rule of Five, VU0618410-1 has 0 hydrogen bond donor(s) and 6 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 VU0618410-1?
The CAS number of VU0618410-1 is 690647-07-5.
What is the molecular formula of VU0618410-1?
The molecular formula of VU0618410-1 is C20H18FN5O2S.
What is the molecular weight of VU0618410-1?
The molecular weight of VU0618410-1 is 411.12 g/mol.
Where can I buy VU0618410-1?
You can request a quote for VU0618410-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0618410-1?
Yes, KEHONG BIO provides custom synthesis services for VU0618410-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.