![2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate structure](/static/products/5787/578734-73-3.webp)
2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate
TL;DR: 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate (CAS 578734-73-3) is a chemical compound with molecular formula C21H20N4O2S3 and molecular weight 456.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] 4-phenylpiperazine-1-carbodithioate
Also Known As: 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate, [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] 4-phenylpiperazine-1-carbodithioate, N-(4-oxobenzo[e]1,3-thiazin-2-yl)-2-[(4-phenylpiperazinyl)thioxomethylthio]ace tamide, [(4-OXO-4H-1,3-BENZOTHIAZIN-2-YL)CARBAMOYL]METHYL 4-PHENYLPIPERAZINE-1-CARBODITHIOATE, 2-oxo-2-((4-oxo-4H-benzo[e][1,3]thiazin-2-yl)amino)ethyl 4-phenylpiperazine-1-carbodithioate
| Molecular Formula | C21H20N4O2S3 |
|---|---|
| Molecular Weight | 456.07 g/mol |
| LogP | 3.4353 |
| Topological Polar Surface Area | 65.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 456.07483 |
| Heavy Atoms | 30 |
| Complexity | 1111.9395 |
Chemical Identifiers
| CAS Number | 578734-73-3 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2)C(=S)SCC(=O)NC3=NC(=O)C4=CC=CC=C4S3 |
Product Overview
2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate (CAS 578734-73-3), with molecular formula C21H20N4O2S3 and molecular weight 456.07 g/mol. IUPAC: [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] 4-phenylpiperazine-1-carbodithioate.
Chemical Property Profile of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate
Property Insights of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate
The XLogP value of 3.4353 indicates that 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate. Following Lipinski's Rule of Five, 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate has 1 hydrogen bond donor(s) and 7 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-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate?
The CAS number of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate is 578734-73-3.
What is the molecular formula of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate?
The molecular formula of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate is C21H20N4O2S3.
What is the molecular weight of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate?
The molecular weight of 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate is 456.07 g/mol.
Where can I buy 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate?
You can request a quote for 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2-[(4-oxo-4H-1,3-benzothiazin-2-yl)amino]ethyl 4-phenylpiperazine-1-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.