![[2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate structure](/static/products/487/487035-89-2.png)
[2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate
TL;DR: [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate (CAS 487035-89-2) is a chemical compound with molecular formula C15H17N3O2S3 and molecular weight 367.05 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] N,N-diethylcarbamodithioate
Also Known As: [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate|Diethyl-dithiocarbamic acid [4-oxo-3,4-dihydro-benzo[e][1,3]thiazin-(2Z)-ylidenecarbamoyl]-methyl ester|N,N-diethylcarbamodithioic acid [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] ester|(Z)-2-oxo-2-((4-oxo-3,4-dihydro-2H-benzo[e][1,3]thiazin-2-ylidene)amino)ethyl diethylcarbamodithioate|[2-oxidanylidene-2-[(4-oxidanylidene-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate|2-[(2-{[(DIETHYLAMINO)CARBOTHIOYL]SULFANYL}ACETYL)IMINO]-4-OXO-3,4-DIHYDRO-2H-1,3-BENZOTHIAZINE|2-oxo-2-{[(2Z)-4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene]amino}ethyl diethylcarbamodithioate|2-oxo-2-{[(2Z)-4-oxo-3,4-dihydro-2H-1,3-benzothiazin-2-ylidene]amino}ethyl diethyldithiocarbamate|N,N-diethylcarbamodithioic acid [2-keto-2-[(4-keto-1,3-benzothiazin-2-yl)amino]ethyl] ester|MLS000591644|SMR000218649|cid_1937672
| Molecular Formula | C15H17N3O2S3 |
|---|---|
| Molecular Weight | 367.05 g/mol |
| LogP | 2.9549 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.04828 |
| Heavy Atoms | 23 |
| Complexity | 771.8963 |
Chemical Identifiers
| CAS Number | 487035-89-2 |
|---|---|
| SMILES | CCN(CC)C(=S)SCC(=O)NC1=NC(=O)C2=CC=CC=C2S1 |
Product Overview
[2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate (CAS 487035-89-2), with molecular formula C15H17N3O2S3 and molecular weight 367.05 g/mol. IUPAC: [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate.
Chemical Property Profile of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate
Property Insights of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate
The XLogP value of 2.9549 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate. Following Lipinski's Rule of Five, [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate has 1 hydrogen bond donor(s) and 6 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-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate?
The CAS number of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate is 487035-89-2.
What is the molecular formula of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate?
The molecular formula of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate is C15H17N3O2S3.
What is the molecular weight of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate?
The molecular weight of [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate is 367.05 g/mol.
Where can I buy [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate?
You can request a quote for [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate 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-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for [2-oxo-2-[(4-oxo-1,3-benzothiazin-2-yl)amino]ethyl] N,N-diethylcarbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.