VU0079684-2
TL;DR: VU0079684-2 (CAS 422281-23-0) is a chemical compound with molecular formula C23H23N3O2S and molecular weight 405.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: VU0079684-2, F3407-3871, 3-[4-oxo-4-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)butyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one, 3-(4-oxo-4-(4-phenyl-5,6-dihydropyridin-1(2H)-yl)butyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one, 3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one
| Molecular Formula | C23H23N3O2S |
|---|---|
| Molecular Weight | 405.15 g/mol |
| LogP | 4.15519 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 405.1511 |
| Heavy Atoms | 29 |
| Complexity | 1177.9424 |
Chemical Identifiers
| CAS Number | 422281-23-0 |
|---|---|
| SMILES | C1CN(CC=C1C2=CC=CC=C2)C(=O)CCCN3C(=O)C4=CC=CC=C4NC3=S |
Product Overview
VU0079684-2 (CAS 422281-23-0), with molecular formula C23H23N3O2S and molecular weight 405.15 g/mol. IUPAC: 3-[4-oxo-4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of VU0079684-2
Property Insights of VU0079684-2
The XLogP value of 4.15519 indicates that VU0079684-2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, VU0079684-2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0079684-2 has 1 hydrogen bond donor(s) and 3 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 VU0079684-2?
The CAS number of VU0079684-2 is 422281-23-0.
What is the molecular formula of VU0079684-2?
The molecular formula of VU0079684-2 is C23H23N3O2S.
What is the molecular weight of VU0079684-2?
The molecular weight of VU0079684-2 is 405.15 g/mol.
Where can I buy VU0079684-2?
You can request a quote for VU0079684-2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0079684-2?
Yes, KEHONG BIO provides custom synthesis services for VU0079684-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.