![5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione structure](/static/products/7017/7017-99-4.webp)
5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
TL;DR: 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione (CAS 7017-99-4) is a chemical compound with molecular formula C33H34N2O7S and molecular weight 602.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione
Also Known As: 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione, 5-(4-butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione
| Molecular Formula | C33H34N2O7S |
|---|---|
| Molecular Weight | 602.21 g/mol |
| LogP | 6.9075 |
| Topological Polar Surface Area | 107.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 602.2087 |
| Heavy Atoms | 43 |
| Complexity | 1679.0411 |
Chemical Identifiers
| CAS Number | 7017-99-4 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)C2C(=C(C3=CC(=CC=C3)OCC)O)C(=O)C(=O)N2C4=NC5=C(S4)C=C(C=C5)OCC)OC |
Product Overview
5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione (CAS 7017-99-4), with molecular formula C33H34N2O7S and molecular weight 602.21 g/mol. IUPAC: 5-(4-butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
Property Insights of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione
The XLogP value of 6.9075 indicates that 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione. Following Lipinski's Rule of Five, 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione has 1 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 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione?
The CAS number of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione is 7017-99-4.
What is the molecular formula of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione?
The molecular formula of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione is C33H34N2O7S.
What is the molecular weight of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione?
The molecular weight of 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione is 602.21 g/mol.
Where can I buy 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione?
You can request a quote for 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)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 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Butoxy-3-methoxyphenyl)-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.