![2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one structure](/static/products/5436/5436-40-8.webp)
2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one
TL;DR: 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one (CAS 5436-40-8) is a chemical compound with molecular formula C26H25FN2O2S and molecular weight 448.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(1-adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one
Also Known As: 2-[2-(1-adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one, 2-[2-(1-adamantyl)-2-oxo-ethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one
| Molecular Formula | C26H25FN2O2S |
|---|---|
| Molecular Weight | 448.16 g/mol |
| LogP | 5.4024 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.16208 |
| Heavy Atoms | 32 |
| Complexity | 1249.018 |
Chemical Identifiers
| CAS Number | 5436-40-8 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC5=CC=CC=C5C(=O)N4C6=CC=CC=C6F |
Product Overview
2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one (CAS 5436-40-8), with molecular formula C26H25FN2O2S and molecular weight 448.16 g/mol. IUPAC: 2-[2-(1-adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one.
Chemical Property Profile of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one
Property Insights of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one
The XLogP value of 5.4024 indicates that 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.96 Ų, 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one?
The CAS number of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one is 5436-40-8.
What is the molecular formula of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one?
The molecular formula of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one is C26H25FN2O2S.
What is the molecular weight of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one?
The molecular weight of 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one is 448.16 g/mol.
Where can I buy 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one?
You can request a quote for 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(1-Adamantyl)-2-oxoethyl]sulfanyl-3-(2-fluorophenyl)quinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.