![3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one structure](/static/products/637/637749-50-9.png)
3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one
TL;DR: 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one (CAS 637749-50-9) is a chemical compound with molecular formula C26H20N2O5S and molecular weight 472.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-yl)-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one
Also Known As: 3-(benzo[d]thiazol-2-yl)-6-ethyl-2-methyl-7-((4-nitrobenzyl)oxy)-4H-chromen-4-one, 3-(1,3-benzothiazol-2-yl)-6-ethyl-2-methyl-7-[(4-nitrobenzyl)oxy]-4H-chromen-4-one, 3-(1,3-benzothiazol-2-yl)-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one, 3-benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one
| Molecular Formula | C26H20N2O5S |
|---|---|
| Molecular Weight | 472.11 g/mol |
| LogP | 6.42772 |
| Topological Polar Surface Area | 95.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 472.10928 |
| Heavy Atoms | 34 |
| Complexity | 1569.2068 |
Chemical Identifiers
| CAS Number | 637749-50-9 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OCC3=CC=C(C=C3)[N+](=O)[O-])OC(=C(C2=O)C4=NC5=CC=CC=C5S4)C |
Product Overview
3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one (CAS 637749-50-9), with molecular formula C26H20N2O5S and molecular weight 472.11 g/mol. IUPAC: 3-(1,3-benzothiazol-2-yl)-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one.
Chemical Property Profile of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one
Property Insights of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one
The XLogP value of 6.42772 indicates that 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one. Following Lipinski's Rule of Five, 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one 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-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one?
The CAS number of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one is 637749-50-9.
What is the molecular formula of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one?
The molecular formula of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one is C26H20N2O5S.
What is the molecular weight of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one?
The molecular weight of 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one is 472.11 g/mol.
Where can I buy 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one?
You can request a quote for 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one 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-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzothiazol-2-yl-6-ethyl-2-methyl-7-[(4-nitrophenyl)methoxy]chromen-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.