3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one
TL;DR: 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one (CAS 675131-52-9) is a chemical compound with molecular formula C14H8F2N2OS and molecular weight 290.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-difluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one
Also Known As: 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one, 3-(2,5-difluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one, 3-(2,5-difluorophenyl)-2-sulfanyl-3-hydroquinazolin-4-one
| Molecular Formula | C14H8F2N2OS |
|---|---|
| Molecular Weight | 290.03 g/mol |
| LogP | 3.32649 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.03253 |
| Heavy Atoms | 20 |
| Complexity | 930.3406 |
Chemical Identifiers
| CAS Number | 675131-52-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C(=S)N2)C3=C(C=CC(=C3)F)F |
Product Overview
3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one (CAS 675131-52-9), with molecular formula C14H8F2N2OS and molecular weight 290.03 g/mol. IUPAC: 3-(2,5-difluorophenyl)-2-sulfanylidene-1H-quinazolin-4-one.
Chemical Property Profile of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one
Property Insights of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one
The XLogP value of 3.32649 indicates that 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.79 Ų, 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one has 1 hydrogen bond donor(s) and 2 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 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one?
The CAS number of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one is 675131-52-9.
What is the molecular formula of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one?
The molecular formula of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one is C14H8F2N2OS.
What is the molecular weight of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one?
The molecular weight of 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one is 290.03 g/mol.
Where can I buy 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one?
You can request a quote for 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,5-difluorophenyl)-2-sulfanylquinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.