RefChem:593756
TL;DR: RefChem:593756 (CAS 609795-38-2) is a chemical compound with molecular formula C32H36N2O7S and molecular weight 592.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3E)-2-(4-butoxyphenyl)-3-[(4-butoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Ethyl 2-(3-(4-butoxybenzoyl)-2-(4-butoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate, 646-979-3, Ethyl 2-(3-(4-butoxybenzoyl)-2-(4-butoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-YL)-4-methyl-1,3-thiazole-5-carboxylate, ethyl 2-[3-(4-butoxybenzoyl)-2-(4-butoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate, RefChem:593756
| Molecular Formula | C32H36N2O7S |
|---|---|
| Molecular Weight | 592.22 g/mol |
| LogP | 6.61232 |
| Topological Polar Surface Area | 115.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 592.2243 |
| Heavy Atoms | 42 |
| Complexity | 1444.4972 |
Chemical Identifiers
| CAS Number | 609795-38-2 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)OCCCC)\O)/C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OCC)C |
Product Overview
RefChem:593756 (CAS 609795-38-2), with molecular formula C32H36N2O7S and molecular weight 592.22 g/mol. IUPAC: ethyl 2-[(3E)-2-(4-butoxyphenyl)-3-[(4-butoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of RefChem:593756
Property Insights of RefChem:593756
The XLogP value of 6.61232 indicates that RefChem:593756 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.26 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:593756. Following Lipinski's Rule of Five, RefChem:593756 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 RefChem:593756?
The CAS number of RefChem:593756 is 609795-38-2.
What is the molecular formula of RefChem:593756?
The molecular formula of RefChem:593756 is C32H36N2O7S.
What is the molecular weight of RefChem:593756?
The molecular weight of RefChem:593756 is 592.22 g/mol.
Where can I buy RefChem:593756?
You can request a quote for RefChem:593756 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:593756?
Yes, KEHONG BIO provides custom synthesis services for RefChem:593756 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.