![(E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate structure](/static/products/637/637747-75-2.png)
(E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate
TL;DR: (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate (CAS 637747-75-2) is a chemical compound with molecular formula C28H19NO6S and molecular weight 497.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate
Also Known As: (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate, 3-benzothiazol-2-yl-2-(ethoxycarbonyl)-4-oxochromen-7-yl (2E)-3-phenylprop-2-e noate, Ethyl 3-benzothiazol-2-yl-4-oxo-7-(3-phenylprop-2-enoyloxy)chromene-2-carboxylate, ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate, ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-{[(2E)-3-phenylprop-2-enoyl]oxy}-4H-chromene-2-carboxylate
| Molecular Formula | C28H19NO6S |
|---|---|
| Molecular Weight | 497.09 g/mol |
| LogP | 5.8652 |
| Topological Polar Surface Area | 95.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 497.09332 |
| Heavy Atoms | 36 |
| Complexity | 1650.5188 |
Chemical Identifiers
| CAS Number | 637747-75-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)/C=C/C3=CC=CC=C3)C4=NC5=CC=CC=C5S4 |
Product Overview
(E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate (CAS 637747-75-2), with molecular formula C28H19NO6S and molecular weight 497.09 g/mol. IUPAC: ethyl 3-(1,3-benzothiazol-2-yl)-4-oxo-7-[(E)-3-phenylprop-2-enoyl]oxychromene-2-carboxylate.
Chemical Property Profile of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate
Property Insights of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate
The XLogP value of 5.8652 indicates that (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate?
The CAS number of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate is 637747-75-2.
What is the molecular formula of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate?
The molecular formula of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate is C28H19NO6S.
What is the molecular weight of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate?
The molecular weight of (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate is 497.09 g/mol.
Where can I buy (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate?
You can request a quote for (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 3-(benzo[d]thiazol-2-yl)-7-(cinnamoyloxy)-4-oxo-4H-chromene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.