![2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one structure](/static/products/3319/331972-17-9.webp)
2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one
TL;DR: 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one (CAS 331972-17-9) is a chemical compound with molecular formula C17H13BrN2O2S and molecular weight 387.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one
Also Known As: AB00094915-01, 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one, 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-methylquinazolin-4(3H)-one, 2-((2-(4-bromophenyl)-2-oxoethyl)thio)-3-methylquinazolin-4(3H)-one
| Molecular Formula | C17H13BrN2O2S |
|---|---|
| Molecular Weight | 387.99 g/mol |
| LogP | 3.671 |
| Topological Polar Surface Area | 51.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 387.9881 |
| Heavy Atoms | 23 |
| Complexity | 935.4714 |
Chemical Identifiers
| CAS Number | 331972-17-9 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)C3=CC=C(C=C3)Br |
Product Overview
2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one (CAS 331972-17-9), with molecular formula C17H13BrN2O2S and molecular weight 387.99 g/mol. IUPAC: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one.
Chemical Property Profile of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one
Property Insights of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one
The XLogP value of 3.671 indicates that 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-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-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one has 0 hydrogen bond donor(s) and 4 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 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one?
The CAS number of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one is 331972-17-9.
What is the molecular formula of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one?
The molecular formula of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one is C17H13BrN2O2S.
What is the molecular weight of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one?
The molecular weight of 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one is 387.99 g/mol.
Where can I buy 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one?
You can request a quote for 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-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-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(4-Bromophenyl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.