RefChem:593767
TL;DR: RefChem:593767 (CAS 609793-22-8) is a chemical compound with molecular formula C31H34N2O9S and molecular weight 610.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4E)-4-[(4-butoxyphenyl)-hydroxymethylidene]-2,3-dioxo-5-(3,4,5-trimethoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Ethyl 2-(3-(4-butoxybenzoyl)-4-hydroxy-5-oxo-2-(3,4,5-trimethoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate, 645-989-5, Ethyl 2-(3-(4-butoxybenzoyl)-4-hydroxy-5-oxo-2-(3,4,5-trimethoxyphenyl)-2,5-DI hydro-1H-pyrrol-1-YL)-4-methyl-1,3-thiazole-5-carboxylate, ETHYL 2-[3-(4-BUTOXYBENZOYL)-4-HYDROXY-5-OXO-2-(3,4,5-TRIMETHOXYPHENYL)-2,5-DI HYDRO-1H-PYRROL-1-YL]-4-METHYL-1,3-THIAZOLE-5-CARBOXYLATE, RefChem:593767
| Molecular Formula | C31H34N2O9S |
|---|---|
| Molecular Weight | 610.20 g/mol |
| LogP | 5.45922 |
| Topological Polar Surface Area | 133.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 12 |
| Exact Mass | 610.1985 |
| Heavy Atoms | 43 |
| Complexity | 1520.025 |
Chemical Identifiers
| CAS Number | 609793-22-8 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC(=C(C(=C4)OC)OC)OC)/O |
Product Overview
RefChem:593767 (CAS 609793-22-8), with molecular formula C31H34N2O9S and molecular weight 610.20 g/mol. IUPAC: ethyl 2-[(4E)-4-[(4-butoxyphenyl)-hydroxymethylidene]-2,3-dioxo-5-(3,4,5-trimethoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of RefChem:593767
Property Insights of RefChem:593767
The XLogP value of 5.45922 indicates that RefChem:593767 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.72 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:593767. Following Lipinski's Rule of Five, RefChem:593767 has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:593767?
The CAS number of RefChem:593767 is 609793-22-8.
What is the molecular formula of RefChem:593767?
The molecular formula of RefChem:593767 is C31H34N2O9S.
What is the molecular weight of RefChem:593767?
The molecular weight of RefChem:593767 is 610.20 g/mol.
Where can I buy RefChem:593767?
You can request a quote for RefChem:593767 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:593767?
Yes, KEHONG BIO provides custom synthesis services for RefChem:593767 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.