![3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate structure](/static/products/3843/384364-53-8.webp)
3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate
TL;DR: 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate (CAS 384364-53-8) is a chemical compound with molecular formula C25H21NO8S and molecular weight 495.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-[3-(1,3-benzothiazol-2-yl)-2-ethoxycarbonyl-6-ethyl-4-oxochromen-7-yl] 1-O-ethyl oxalate
Also Known As: 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate, 2-O-[3-(1,3-benzothiazol-2-yl)-2-ethoxycarbonyl-6-ethyl-4-oxochromen-7-yl] 1-O-ethyl oxalate, (3-benzothiazol-2-yl-2-ethoxycarbonyl-6-ethyl-4-oxo-chromen-7-yl) Ethyl Oxalate, 3-benzothiazol-2-yl-2-(ethoxycarbonyl)-6-ethyl-4-oxochromen-7-yl ethyl ethane- 1,2-dioate, 3-(1,3-benzothiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl ethanedioate
| Molecular Formula | C25H21NO8S |
|---|---|
| Molecular Weight | 495.10 g/mol |
| LogP | 4.2773 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.0988 |
| Heavy Atoms | 35 |
| Complexity | 1484.4631 |
Chemical Identifiers
| CAS Number | 384364-53-8 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OC(=O)C(=O)OCC)OC(=C(C2=O)C3=NC4=CC=CC=C4S3)C(=O)OCC |
Product Overview
3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate (CAS 384364-53-8), with molecular formula C25H21NO8S and molecular weight 495.10 g/mol. IUPAC: 2-O-[3-(1,3-benzothiazol-2-yl)-2-ethoxycarbonyl-6-ethyl-4-oxochromen-7-yl] 1-O-ethyl oxalate.
Chemical Property Profile of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate
Property Insights of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate
The XLogP value of 4.2773 indicates that 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate. Following Lipinski's Rule of Five, 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate has 0 hydrogen bond donor(s) and 10 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 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate?
The CAS number of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate is 384364-53-8.
What is the molecular formula of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate?
The molecular formula of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate is C25H21NO8S.
What is the molecular weight of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate?
The molecular weight of 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate is 495.10 g/mol.
Where can I buy 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate?
You can request a quote for 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate?
Yes, KEHONG BIO provides custom synthesis services for 3-(benzo[d]thiazol-2-yl)-2-(ethoxycarbonyl)-6-ethyl-4-oxo-4H-chromen-7-yl ethyl oxalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.