6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate
TL;DR: 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate (CAS 308297-72-5) is a chemical compound with molecular formula C22H25NO4S and molecular weight 399.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-2-propan-2-ylchromen-7-yl] 2-methylpropanoate
Also Known As: 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate, VU0036031-2, 6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-2-(propan-2-yl)-4H-chromen-7-yl 2-methylpropanoate, F3139-0083, [6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-2-propan-2-ylchromen-7-yl] 2-methylpropanoate
| Molecular Formula | C22H25NO4S |
|---|---|
| Molecular Weight | 399.15 g/mol |
| LogP | 5.47212 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.15042 |
| Heavy Atoms | 28 |
| Complexity | 1091.8452 |
Chemical Identifiers
| CAS Number | 308297-72-5 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1OC(=O)C(C)C)OC(=C(C2=O)C3=NC(=CS3)C)C(C)C |
Product Overview
6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate (CAS 308297-72-5), with molecular formula C22H25NO4S and molecular weight 399.15 g/mol. IUPAC: [6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-2-propan-2-ylchromen-7-yl] 2-methylpropanoate.
Chemical Property Profile of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate
Property Insights of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate
The XLogP value of 5.47212 indicates that 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate 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 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate. Following Lipinski's Rule of Five, 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate?
The CAS number of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate is 308297-72-5.
What is the molecular formula of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate?
The molecular formula of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate is C22H25NO4S.
What is the molecular weight of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate?
The molecular weight of 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate is 399.15 g/mol.
Where can I buy 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate?
You can request a quote for 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate?
Yes, KEHONG BIO provides custom synthesis services for 6-ethyl-2-isopropyl-3-(4-methylthiazol-2-yl)-4-oxo-4H-chromen-7-yl isobutyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.