![6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one structure](/static/products/4237/423729-71-9.webp)
6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one
TL;DR: 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one (CAS 423729-71-9) is a chemical compound with molecular formula C22H17BrN2O2S and molecular weight 452.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one
Also Known As: BIM-0030559.P001, 6-bromo-2-[(4-methoxybenzyl)sulfanyl]-3-phenylquinazolin-4(3H)-one, 6-bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one, 6-bromo-2-((4-methoxybenzyl)thio)-3-phenylquinazolin-4(3H)-one, 6-bromo-2-[(4-methoxybenzyl)thio]-3-phenylquinazolin-4(3H)-one
| Molecular Formula | C22H17BrN2O2S |
|---|---|
| Molecular Weight | 452.02 g/mol |
| LogP | 5.4491 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 452.0194 |
| Heavy Atoms | 28 |
| Complexity | 1174.9994 |
Chemical Identifiers
| CAS Number | 423729-71-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4 |
Product Overview
6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one (CAS 423729-71-9), with molecular formula C22H17BrN2O2S and molecular weight 452.02 g/mol. IUPAC: 6-bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one.
Chemical Property Profile of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one
Property Insights of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one
The XLogP value of 5.4491 indicates that 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-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 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one?
The CAS number of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one is 423729-71-9.
What is the molecular formula of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one?
The molecular formula of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one is C22H17BrN2O2S.
What is the molecular weight of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one?
The molecular weight of 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one is 452.02 g/mol.
Where can I buy 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one?
You can request a quote for 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-2-[(4-methoxyphenyl)methylsulfanyl]-3-phenylquinazolin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.