3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate
TL;DR: 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate (CAS 618391-65-4) is a chemical compound with molecular formula C26H19NO7S and molecular weight 489.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 3,4,5-trimethoxybenzoate
Also Known As: (3-benzothiazol-2-yl-2-oxo-chromen-7-yl) 3,4,5-trimethoxybenzoate, 3-benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate, [3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 3,4,5-trimethoxybenzoate, 3-(benzo[d]thiazol-2-yl)-2-oxo-2H-chromen-7-yl 3,4,5-trimethoxybenzoate, 3-(1,3-benzothiazol-2-yl)-2-oxo-2H-chromen-7-yl 3,4,5-trimethoxybenzoate
| Molecular Formula | C26H19NO7S |
|---|---|
| Molecular Weight | 489.09 g/mol |
| LogP | 5.3147 |
| Topological Polar Surface Area | 97.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 489.08823 |
| Heavy Atoms | 35 |
| Complexity | 1578.46 |
Chemical Identifiers
| CAS Number | 618391-65-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5S4 |
Product Overview
3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate (CAS 618391-65-4), with molecular formula C26H19NO7S and molecular weight 489.09 g/mol. IUPAC: [3-(1,3-benzothiazol-2-yl)-2-oxochromen-7-yl] 3,4,5-trimethoxybenzoate.
Chemical Property Profile of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate
Property Insights of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate
The XLogP value of 5.3147 indicates that 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate?
The CAS number of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate is 618391-65-4.
What is the molecular formula of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate?
The molecular formula of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate is C26H19NO7S.
What is the molecular weight of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate?
The molecular weight of 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate is 489.09 g/mol.
Where can I buy 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate?
You can request a quote for 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzothiazol-2-yl-2-oxochromen-7-yl 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.