![2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one structure](/static/products/1022/1022674-58-3.webp)
2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one
TL;DR: 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one (CAS 1022674-58-3) is a chemical compound with molecular formula C18H16ClNO2S and molecular weight 345.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-chlorophenyl)sulfanylethyl]-6,8-dimethyl-3,1-benzoxazin-4-one
Also Known As: 2-((4-CHLOROPHENYLTHIO)ETHYL)-6,8-DIMETHYLBENZO[D]1,3-OXAZIN-4-ONE, 2-[1-(4-chlorophenyl)sulfanylethyl]-6,8-dimethyl-3,1-benzoxazin-4-one, 2-{1-[(4-chlorophenyl)sulfanyl]ethyl}-6,8-dimethyl-3,1-benzoxazin-4-one, 2-(1-((4-Chlorophenyl)thio)ethyl)-6,8-dimethyl-4H-benzo[d][1,3]oxazin-4-one, 2-{1-[(4-chlorophenyl)sulfanyl]ethyl}-6,8-dimethyl-4H-3,1-benzoxazin-4-one
| Molecular Formula | C18H16ClNO2S |
|---|---|
| Molecular Weight | 345.06 g/mol |
| LogP | 5.31154 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.05902 |
| Heavy Atoms | 23 |
| Complexity | 918.6932 |
Chemical Identifiers
| CAS Number | 1022674-58-3 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C(=O)OC(=N2)C(C)SC3=CC=C(C=C3)Cl)C |
Product Overview
2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one (CAS 1022674-58-3), with molecular formula C18H16ClNO2S and molecular weight 345.06 g/mol. IUPAC: 2-[1-(4-chlorophenyl)sulfanylethyl]-6,8-dimethyl-3,1-benzoxazin-4-one.
Chemical Property Profile of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one
Property Insights of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one
The XLogP value of 5.31154 indicates that 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-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-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one?
The CAS number of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one is 1022674-58-3.
What is the molecular formula of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one?
The molecular formula of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one is C18H16ClNO2S.
What is the molecular weight of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one?
The molecular weight of 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one is 345.06 g/mol.
Where can I buy 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one?
You can request a quote for 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-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-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Chlorophenylthio)ethyl)-6,8-dimethylbenzo[D]1,3-oxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.