![1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione structure](/static/products/7018/7018-58-8.webp)
1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
TL;DR: 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione (CAS 7018-58-8) is a chemical compound with molecular formula C30H28N2O6S and molecular weight 544.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione, 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C30H28N2O6S |
|---|---|
| Molecular Weight | 544.17 g/mol |
| LogP | 5.95534 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 544.1668 |
| Heavy Atoms | 39 |
| Complexity | 1639.9703 |
Chemical Identifiers
| CAS Number | 7018-58-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2C(=C(C3=CC(=CC=C3)OC)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C)OC |
Product Overview
1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione (CAS 7018-58-8), with molecular formula C30H28N2O6S and molecular weight 544.17 g/mol. IUPAC: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy-(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
Property Insights of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione
The XLogP value of 5.95534 indicates that 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione. Following Lipinski's Rule of Five, 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione has 1 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 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione?
The CAS number of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione is 7018-58-8.
What is the molecular formula of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione?
The molecular formula of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione is C30H28N2O6S.
What is the molecular weight of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione?
The molecular weight of 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione is 544.17 g/mol.
Where can I buy 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione?
You can request a quote for 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxy-3-methoxyphenyl)-4-[hydroxy(3-methoxyphenyl)methylidene]pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.