![1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone structure](/static/products/606/606132-40-5.png)
1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone
TL;DR: 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone (CAS 606132-40-5) is a chemical compound with molecular formula C23H25N3OS and molecular weight 391.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone
Also Known As: 3-Bromoacetophenone diethyl ke, ASN 06977473, 1-Azepan-1-yl-2-(2-p-tolyl-quinazolin-4-ylsulfanyl)-ethanone, 1-(azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone, 1h-azepine,hexahydro-1-[[[2-(4-methylphenyl)-4-quinazolinyl]thio]acetyl]-
| Molecular Formula | C23H25N3OS |
|---|---|
| Molecular Weight | 391.17 g/mol |
| LogP | 5.09992 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.17184 |
| Heavy Atoms | 28 |
| Complexity | 963.2483 |
Chemical Identifiers
| CAS Number | 606132-40-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=N2)SCC(=O)N4CCCCCC4 |
Product Overview
1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone (CAS 606132-40-5), with molecular formula C23H25N3OS and molecular weight 391.17 g/mol. IUPAC: 1-(azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone.
Chemical Property Profile of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone
Property Insights of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone
The XLogP value of 5.09992 indicates that 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone 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 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone?
The CAS number of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone is 606132-40-5.
What is the molecular formula of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone?
The molecular formula of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone is C23H25N3OS.
What is the molecular weight of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone?
The molecular weight of 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone is 391.17 g/mol.
Where can I buy 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone?
You can request a quote for 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azepan-1-yl)-2-[2-(4-methylphenyl)quinazolin-4-yl]sulfanylethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.