ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate
TL;DR: ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate (CAS 66870-48-2) is a chemical compound with molecular formula C7H11N3O2S and molecular weight 201.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate
Also Known As: Ethyl 2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate, (2-amino-6H-[1,3,4]thiadiazin-5-yl)-acetic acid ethyl ester, ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate
| Molecular Formula | C7H11N3O2S |
|---|---|
| Molecular Weight | 201.06 g/mol |
| LogP | -0.0005 |
| Topological Polar Surface Area | 76.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.0572 |
| Heavy Atoms | 13 |
| Complexity | 262.46326 |
Chemical Identifiers
| CAS Number | 66870-48-2 |
|---|---|
| SMILES | CCOC(=O)/C=C\1/CSC(=NN1)N |
Product Overview
ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate (CAS 66870-48-2), with molecular formula C7H11N3O2S and molecular weight 201.06 g/mol. IUPAC: ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate.
Chemical Property Profile of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate
Property Insights of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate
The XLogP value of -0.0005 indicates that ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 76.71 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate. Following Lipinski's Rule of Five, ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate has 2 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 ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate?
The CAS number of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate is 66870-48-2.
What is the molecular formula of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate?
The molecular formula of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate is C7H11N3O2S.
What is the molecular weight of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate?
The molecular weight of ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate is 201.06 g/mol.
Where can I buy ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate?
You can request a quote for ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (2Z)-2-(2-amino-4H-1,3,4-thiadiazin-5-ylidene)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.