![ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE structure](/static/products/848/848299-03-6.png)
ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE
TL;DR: ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE (CAS 848299-03-6) is a chemical compound with molecular formula C16H16N2O7S and molecular weight 380.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate
Also Known As: ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE, ethyl (2Z)-{3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene}acetate, ethyl 2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate
| Molecular Formula | C16H16N2O7S |
|---|---|
| Molecular Weight | 380.07 g/mol |
| LogP | 1.9412 |
| Topological Polar Surface Area | 108.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.0678 |
| Heavy Atoms | 26 |
| Complexity | 793.0481 |
Chemical Identifiers
| CAS Number | 848299-03-6 |
|---|---|
| SMILES | CCOC(=O)C=C1N(C(=O)CS1)CC2=CC(=CC3=C2OCOC3)[N+](=O)[O-] |
Product Overview
ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE (CAS 848299-03-6), with molecular formula C16H16N2O7S and molecular weight 380.07 g/mol. IUPAC: ethyl 2-[3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate.
Chemical Property Profile of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE
Property Insights of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE
The XLogP value of 1.9412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE. The TPSA of 108.21 Ų falls within the moderate polarity range, balancing permeability and solubility for ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE. Following Lipinski's Rule of Five, ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE has 0 hydrogen bond donor(s) and 8 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 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE?
The CAS number of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE is 848299-03-6.
What is the molecular formula of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE?
The molecular formula of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE is C16H16N2O7S.
What is the molecular weight of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE?
The molecular weight of ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE is 380.07 g/mol.
Where can I buy ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE?
You can request a quote for ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-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 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE?
Yes, KEHONG BIO provides custom synthesis services for ETHYL 2-{3-[(6-NITRO-2,4-DIHYDRO-1,3-BENZODIOXIN-8-YL)METHYL]-4-OXO-1,3-THIAZOLIDIN-2-YLIDENE}ACETATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.