![[3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate structure](/static/products/3843/384374-93-0.webp)
[3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate
TL;DR: [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate (CAS 384374-93-0) is a chemical compound with molecular formula C25H19NO4S2 and molecular weight 461.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate
Also Known As: [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate, (3-benzothiazol-2-yl-8-methyl-4-oxo-2-propan-2-yl-chromen-7-yl) Thiophene-2-carboxylate, 3-benzothiazol-2-yl-8-methyl-2-(methylethyl)-4-oxochromen-7-yl thiophene-2-car boxylate, 3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-(propan-2-yl)-4H-chromen-7-yl thiophene-2-carboxylate, 3-(benzo[d]thiazol-2-yl)-2-isopropyl-8-methyl-4-oxo-4H-chromen-7-yl thiophene-2-carboxylate
| Molecular Formula | C25H19NO4S2 |
|---|---|
| Molecular Weight | 461.08 g/mol |
| LogP | 6.78222 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 461.07556 |
| Heavy Atoms | 32 |
| Complexity | 1494.4362 |
Chemical Identifiers
| CAS Number | 384374-93-0 |
|---|---|
| SMILES | CC1=C(C=CC2=C1OC(=C(C2=O)C3=NC4=CC=CC=C4S3)C(C)C)OC(=O)C5=CC=CS5 |
Product Overview
[3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate (CAS 384374-93-0), with molecular formula C25H19NO4S2 and molecular weight 461.08 g/mol. IUPAC: [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate.
Chemical Property Profile of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate
Property Insights of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate
The XLogP value of 6.78222 indicates that [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate. Following Lipinski's Rule of Five, [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate?
The CAS number of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate is 384374-93-0.
What is the molecular formula of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate?
The molecular formula of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate is C25H19NO4S2.
What is the molecular weight of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate?
The molecular weight of [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate is 461.08 g/mol.
Where can I buy [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate?
You can request a quote for [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for [3-(1,3-benzothiazol-2-yl)-8-methyl-4-oxo-2-propan-2-ylchromen-7-yl] thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.